Buta-1,3-Diene 丁-1,3-二烯
CAS 106-99-0 MFCD00008659
化学结构图
SMILES: C=CC=C
化学属性
| Mol. Formula | C4H6 |
|---|---|
| Mol. Weight | 54.09 |
| Autoignition Point | 788 °F |
| Density | 0.62 g/mL at 20 °C(lit.) |
| Vapor Density | 1.9 (15 °C, vs air) |
| Boiling Point | -4.5 °C(lit.) |
| Vapor Pressure | 1863 mmHg ( 21 °C) |
| Melting Point | -109 °C(lit.) |
| Refractive index | n20/D 1.376 |
| Solubility | 溶于丙酮、苯、乙酸、酯等多数有机溶剂。 |
| Flash Point | -105 °F |
| Stability | 对热和湿度敏感 |
别名和识别编码
| Chemical Name | Buta-1,3-Diene |
|---|---|
| MDL Number | MFCD00008659 |
| CAS Number | 106-99-0 |
| Synonym | 1,3-butadiene Vinylethylene BUTADIENE {uni_hamburg} 1 乙烯基乙烯 BIETHYLENE 丁间二烯 VINYLETHYLENE butadiene(non-specificname) Α,Γ-丁二烯 1，3-丁二烯 divinyl BIVINYL α,γ-butadiene 联乙烯 二乙烯 a,g-Butadiene Butadieen alpha-butadiene 雙乙烯基 alpha,gamma-Butadiene Bivinyl 1,3-丁二烯 1,3-BUTADIENE NCI-C50602 Butadien-(1,3) PYRROLYLENE butadien(polish) 3-丁二烯 丁二烯残液 Biethylene Erythrene 雙乙烯 Butadiene Buta-1,3-dien 1,3-Butadiene vinylethylene 聯乙烯 Buta-1,3-diene bivinyl (E)-CH2=CHCH=CH2 1,3-丁二烯 062-01 [2.1] Butadien erythrene a, g-Butadiene DIVINYL Buta-1,3-dieen butadiene-1,3 1,3-丁二烯 溶液 Pyrrolylene BUDIENE buta-1,3-diene biethylene ERYTHRENE 1-methylallene Divinyl 丁二烯 C4H6 (buta-1,3-diene) |
| EC Number | 203-450-8 |
| Beilstein Registry Number | 605258 |
| PubChem Substance ID | 253660912 |
| Chemical Name Translation | 丁-1,3-二烯 |
| Merck Number | 1509 |
| Reaxys-RN | 605258 |
| Wiswesser Line Notation | 1U2U1 |
| LabNetwork Molecule ID | LN00241931 |
| InChI | InChI=1S/C4H6/c1-3-4-2/h3-4H,1-2H2 |
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分类
- {SNA} Chemical Synthesis, Specialty Gases, Synthetic Reagents, 癌症研究, 细胞生物学, 致癌物
- {SNA} Acyclic, Alkenes, Building Blocks, Chemical Synthesis, Organic Building Blocks
- {SNA} Acyclic, Alkenes, Building Blocks, Chemical Synthesis, Organic Building Blocks, Specialty Gases, Synthetic Reagents
- {uni_hamburg} no charge; 1fragment
- {SA} Cancer Research, Carcinogens, Chemical Synthesis, Specialty Gases, Synthetic Reagents
- {SNA} Chemical Synthesis, Specialty Gases, Synthetic Reagents
产品应用
- 丁二烯是生产合成橡胶（丁苯橡胶、顺丁橡胶、丁腈橡胶、氯丁橡胶）的主要原料。
相关文献及参考
- Short: II/25C
- Merck:1509
- Short: II/19b
安全信息
GHS Symbol
- H315 Causes skin irritation 会刺激皮肤
- H304 May be fatal if swallowed and enters airways 吞食和进入呼吸道可能致命
- H336 May cause drowsiness or dizziness 肯能导致嗜睡或头晕
- H350 May cause cancer 可能致癌
- H411 Toxictoaquaticlifewithlonglastingeffects 对水生生物有毒性并具有长期影响。
- H340 May cause genetic defects 可能导致遗传性缺陷
- H361 Suspected of damaging fertility or the unborn child 怀疑对生育能力或未出生婴儿造成伤害
- H225 Highly flammable liquid and vapour 高度易燃液体和蒸气
- H373 May causes damage to organs through prolonged or repeated exposure 长期或频繁接触可能会损伤器官
- H220 Extremely flammable gas 极易燃气体。
- H280 Contains gas under pressure; may explode if heated 内含高压气体，遇热可能爆炸。
- P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
- P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
- P410+P403
- P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
- P308+P313
- P201 Obtain special instructions before use. 使用前获取专门指示。
- P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
- P332+P313
- P501 Dispose of contents/container to..… 处理内容物/容器.....
- P301+P312+P330
- P337+P313
- P403+P233
- P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
- P303+P361+P353
- P302+P352+P332+P313+P362+P364
- P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
- P301+P310
- P304+P340+P312
- P331 Do NOT induce vomiting.. 不要催吐。
- P304+P340
- P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
- P241 Use explosion-proof electrical/ventilating/lighting/…/equipment. 使用防爆电气/通风/照明/ .../设备。
- P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
- P202 Do not handle until all safety precautions have been read and understood. 已阅读并理解所有的安全预防措施之前，切勿操作。
- P304+
- S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
- S53 Avoid exposure - obtain special instructions before use 避免接触，使用前获得特别指示说明；
- S62 If swallowed, do not induce vomiting: seek medical advice immediately and show this container or label where possible 吞食后不要催吐：立即求医并出示该容器或标签；
- S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
- S16 Keep away from sources of ignition - No smoking 远离火源，禁止吸烟；
- S33 Take precautionary measures against static discharges 对静电采取预防措施；
- S46 If swallowed, seek medical advice immediately and show this container or label 食入时，立即求医并出示容器/标签；
- S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
- S61 Avoid release to the environment. Refer to special instructions/safety data sheet 避免释放到环境中，参考特别指示/安全收据说明书；
- R46 May cause inheritable genetic damage 可能引起遗传基因损害
- R12 Extremely flammable 极端易燃
- R45 May cause cancer 可能致癌
- R63 Possible risk of harm to the unborn child 可能危害未出生婴儿
- R36/38 Irritating to eyes and skin 对眼睛和皮肤有刺激性
- R11 Highly flammable 非常易燃
- R48/20
- R67 Vapours may cause drowsiness and dizziness 蒸汽可能导致嗜睡和昏厥
- R51/53
- R65 Harmful: may cause lung damage if swallowed 若吞咽可能伤害肺部器官
- R38 Irritating to skin 刺激皮肤
- R62 Possible risk of impaired fertility 有削弱生殖能力的危险
TYPE OF TEST : TCLo - Lowest published toxic concentration ROUTE OF EXPOSURE : Inhalation SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 625 ppm/6H/13W-I TOXIC EFFECTS : Tumorigenic - Carcinogenic by RTECS criteria Sense Organs and Special Senses (Olfaction) - tumors Cardiac - tumors REFERENCE : CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 50,6592,1990
TYPE OF TEST : TC - Toxic concentration (other than lowest) ROUTE OF EXPOSURE : Inhalation SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 8000 ppm/6H/2Y-I TOXIC EFFECTS : Tumorigenic - neoplastic by RTECS criteria Gastrointestinal - tumors Endocrine - thyroid tumors REFERENCE : AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 48,407,1987
TYPE OF TEST : TC - Toxic concentration (other than lowest) ROUTE OF EXPOSURE : Inhalation SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 200 ppm/40W-I TOXIC EFFECTS : Tumorigenic - equivocal tumorigenic agent by RTECS criteria Gastrointestinal - tumors REFERENCE : EVHPAZ EHP, Environmental Health Perspectives. (U.S. Government Printing Office, Supt of Documents, Washington, DC 20402) No.1- 1972- Volume(issue)/page/year: 86,37,1990
TYPE OF TEST : TC - Toxic concentration (other than lowest) ROUTE OF EXPOSURE : Inhalation SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 63 ppm/6H/2Y-I TOXIC EFFECTS : Tumorigenic - Carcinogenic by RTECS criteria Vascular - tumors Liver - tumors REFERENCE : NTPTR* National Toxicology Program Technical Report Series. (Research Triangle Park, NC 27709) No.
TYPE OF TEST : TCLo - Lowest published toxic concentration ROUTE OF EXPOSURE : Inhalation SPECIES OBSERVED : Human DOSE/DURATION : 2000 ppm/7H TOXIC EFFECTS : Sense Organs and Special Senses (Eye) - effect, not otherwise specified Behavioral - hallucinations, distorted perceptions REFERENCE : JIHTAB Journal of Industrial Hygiene and Toxicology. (Cambridge, MA) V.18-31, 1936-49. For publisher information,
TYPE OF TEST : LC50 - Lethal concentration, 50 percent kill ROUTE OF EXPOSURE : Inhalation SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 285 gm/m3/4H TOXIC EFFECTS : Behavioral - general anesthetic Lungs, Thorax, or Respiration - respiratory depression REFERENCE : RPTOAN Russian Pharmacology and Toxicology (English Translation). Translation of FATOAO. (Euromed Pub., 33, Woodlands Rd., Surbiton, Surrey, UK) V.30- 1967- Volume(issue)/page/year: 31,162,1968
TYPE OF TEST : TCLo - Lowest published toxic concentration ROUTE OF EXPOSURE : Inhalation SPECIES OBSERVED : Human DOSE/DURATION : 8000 ppm TOXIC EFFECTS : Sense Organs and Special Senses (Eye) - visual field changes Sense Organs and Special Senses (Eye) - conjunctive irritation Lungs, Thorax, or Respiration - cough REFERENCE : INMEAF Industrial Medicine. (Chicago, IL) V.1-18, 1932-49. For publisher information, see IOHSA5. Volume(issue)/page/year: 17,199,1948
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 5480 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : 85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,14,1986
TYPE OF TEST : Mutation in microorganisms TEST SYSTEM : Bacteria - Salmonella typhimurium DOSE/DURATION : 2 pph REFERENCE : TOLED5 Toxicology Letters. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1977- Volume(issue)/page/year: 6,125,1980
TYPE OF TEST : Sperm Morphology ROUTE OF EXPOSURE : Inhalation TEST SYSTEM : Rodent - mouse DOSE/DURATION : 130 ppm/5D/6H (Continuous) REFERENCE : MUREAV Mutation Research. (Elsevier Science Pu
TYPE OF TEST : Sister chromatid exchange TEST SYSTEM : Human Lymphocyte DOSE/DURATION : 500 umol/L REFERENCE : MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 2
TYPE OF TEST : Cytogenetic analysis ROUTE OF EXPOSURE : Inhalation TEST SYSTEM : Rodent - mouse DOSE/DURATION : 625 ppm/6H/10D (Intermittent) REFERENCE : ENMUDM Environmental Mutagenesis. (New York, NY) V.1-9, 1979-87. For publisher information, see EMMUEG. Volume(issue)/page/year: 9,235,1987
TYPE OF TEST : Sister chromatid exchange TEST SYSTEM : Rodent - hamster Ovary DOSE/DURATION : 25 umol/L REFERENCE : MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 263,47,1991
TYPE OF TEST : Mutation in mammalian somatic cells ROUTE OF EXPOSURE : Inhalation TEST SYSTEM : Rodent - mouse DOSE/DURATION : 625 ppm/6H/2W (Intermittent) REFERENCE : CRNGDP Carcinogenesis (London). (Oxford Univ. Press, Pinkhill House, Southfield Road, Eynsham, Oxford OX8 1JJ, UK) V.1- 1980- Volume(issue)/page/year: 15,719,1994
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TYPE OF TEST : TCLo - Lowest published toxic concentration ROUTE OF EXPOSURE : Inhalation SPECIES OBSERVED : Rodent - rat DOSE : 8000 ppm/6H SEX/DURATION : female 6-15 day(s) after conception TOXIC EFFECTS : Reproductive - Specific Developmental Abnormalities - musculoskeletal system REFERENCE : EPASR* United States Environmental Protection Agency, Office of Pesticides and Toxic Substances. (U.S. Environmental Protection Agency, 401 M St., SW, Washington, DC 20460) History unknown. Volume(issue)/page/year: 8EHQ-0382-0441
TYPE OF TEST : TCLo - Lowest published toxic concentration ROUTE OF EXPOSURE : Inhalation SPECIES OBSERVED : Rodent - mouse DOSE : 1000 ppm/6H SEX/DURATION : female 6-15 day(s) after conception TOXIC EFFECTS : Reproductive - Maternal Effects - uterus, cervix, vagina REFERENCE : EVHPAZ EHP, Environmental Health Perspectives. (U.S. Government Printing Office, Supt of Documents, Washington, DC 20402) No.1- 1972- Volume(issue)/page/year: 86,79,1990
TYPE OF TEST : TCLo - Lowest published toxic concentration ROUTE OF EXPOSURE : Inhalation SPECIES OBSERVED : Rodent - mouse DOSE : 500 ppm/6H SEX/DURATION : male 5 day(s) pre-mating TOXIC EFFECTS : Reproductive - Paternal Effects - testes, epididymis, sperm duct Reproductive - Effects on Embryo or Fetus - cytological changes (including somatic cell genetic material) REFERENCE : MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amste
TYPE OF TEST : TCLo - Lowest published toxic concentration ROUTE OF EXPOSURE : Inhalation SPECIES OBSERVED : Rodent - mouse DOSE : 1000 ppm/6H SEX/DURATION : female 6-15 day(s) after conception TOXIC EFFECTS
其他信息
- 外观性质:无色无臭气体。
- 上游原料:甲苯 --> 氮 --> 乙腈 --> 石脑油，原油 --> 碳化钙 --> 正丁烷
- 常规方法:丁二烯在贮存中易聚合，主要由于容器中存在空气以至生成过氧化物。避免的方法是保证容器清洁和干燥，并进行惰性气体置换和氮封。较长时间贮存及运输时，为防止其自动聚合，需考虑加入一定量的阻聚剂。加入阻聚剂的丁二烯在使用前必须进行酸洗（无机酸）脱除阻聚剂。
- TCI Shanghai:1,3-丁二烯(置于无阀气瓶中)(含稳定剂叔丁基邻苯二酚) 1,3-Butadiene (stabilized with TBC) (in cylinder without valve) [To use this product charged in cylinder, a valve is required which is sold separately (Product Code:V0030)],>;95.0%(GC)(106-99-0)
- 防护措施:本品毒性较小，其毒性与乙烯类似，但对皮肤和粘膜的刺激较强，高浓度时有麻醉作用。动物吸入0.67%浓度的丁二烯，每天7.5小时，经8个月，除少数例外，一般对生长和健康无妨碍。工作场所最高容许浓度为2200mg/m3。液态丁二烯因低温可造成冻伤
- 用途二:丁二烯是生产合成橡胶（丁苯橡胶、顺丁橡胶、丁腈橡胶、氯丁橡胶）的主要原料。随着苯乙烯塑料的发展，利用苯乙烯与丁二烯共聚，生产各种用途广泛的树脂（如ABS树脂、SBS树脂、BS树脂、MBS树脂），使丁二烯在树脂生产中逐渐占有重要地位。此外，丁二
- 急
- 储运特性:库房通风低温干燥; 轻装轻卸; 与氧气、空气等助燃气体钢瓶分开存放
- 用途一:用作合成橡胶、合成树脂、合成纤维、增塑剂和乳胶漆等的原料
- 下游产品:环丁砜 --> 1,6-已烷二胺 --> 聚苯乙烯丁二烯共聚物 --> 离子交换树脂 --> 4-乙烯基-1-环己烯二环氧化物,异构体混合物 --> 杂醇油 --> 正丁烯 --> N-羟甲基-3,4,5,6-四氢邻苯二甲酰亚胺 --> 2-(2-氯乙氧基)苯磺酰胺 --> 克菌丹 --> 1,4-二氰基丁烷 --> 甲萘醌 --> 四氢苯酐 --> 顺丁烯二酰肼 --> 交联剂 --> 六溴环十二烷 --> 仲丁醇 --> 十二烷二酸 --> 乙叉降冰生烯 --> N,N,N',N'-四甲基-2-丁烯-1,4-二胺 --> 甲基丙烯腈 --> 改性SBR涂饰剂 --> 环十二烷 --> 四氢化邻苯二甲酸酐 --> 酮麝香 --> 丁腈胶NBR --> 聚丁二烯 --> ABS 树脂 --> 1-烯丙基丙烯 --> 3-环丁烯砜 --> 聚乙烯吡咯烷酮 --> LHYJ-DS50型丁二烯树脂乳液 --> 1,5,9-环十二烷三烯 --> 2,4,4-三甲基-1-戊烯 --> 钛、钴齐格勒催化剂等 --> 羧基丁苯胶乳 --> 4-(2,5,6,6-四甲基-2-环己烯-1-基)-3-丁烯-2-酮 --> 丁苯胶乳 --> 1,4-二乙酰氧基-2-甲基萘 --> 1,2,3,4-四溴丁烷
- 用途三:丁二烯是生产合成橡胶（丁苯橡胶、顺丁橡胶、丁腈橡胶、氯丁橡胶）的主要原料。
- 毒性分级:中毒
- 下游产品:环丁砜 --> 1,6-已烷二胺 --> 聚苯乙烯丁二烯共聚物 --> 离子交换树脂 --> 4-乙烯基-1-环己烯二环氧化物,异构体混合物 --> 杂醇油 --> 正丁烯 --> N-羟甲基-3,4,5,6-四氢邻苯二甲酰亚胺 --> 2-(2-氯乙氧基)苯磺酰胺 --> 克菌丹 --> 1,4-二氰基丁烷 --> 甲萘醌 --> 四氢苯酐 --> 顺丁烯二酰肼 --> 交联剂 --> 六溴环十二烷 --> 仲丁醇 --> 十二烷二酸 --> 乙叉降冰生烯 --> N,N,N',N'-四甲基-2-丁烯-1,4-二胺 --> 甲基丙烯腈 --> 改性SBR涂饰剂 --> 环十二烷 --> 四氢化邻苯二甲酸酐 --> 酮麝香 --> 丁腈胶NBR --> 聚丁二烯 --> ABS 树脂 --> 1-烯丙基丙
- 职业标准:TWA 22
- F:4.5-31
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