TETRANITROMETHANE 四硝基甲烷

CAS 509-14-8 MFCD00007391

化学结构图

509-14-8
SMILES: [O-][N+](=O)C([N+]([O-])=O)([N+]([O-])=O)[N+]([O-])=O

化学属性

Mol. FormulaCN4O8
Mol. Weight196.05
Refractive indexn20/D 1.438(lit.)
Boiling Point126 °C(lit.)
Density1.637 g/mL at 25 °C(lit.)
Melting Point13-14 °C(lit.)
Vapor Pressure8.4 mmHg ( 20 °C)
Flash Point>;230 °F
Solubility不溶于水，可混溶于乙醇、乙醚。

别名和识别编码

Chemical NameMethane, tetranitro-
Synonym {uni_hamburg} NSC 16146 TNM Methane,tetranitro- Rcra waste number P112 tetan tetranitromethane Tetranitromethane(R) Methane, tetranitro- 四硝甲烷 tetranitro-methane tetranitro-methan NCI-C55947 RCRA waste number P112 Methane,tetranitro-(R) Tetranitromethane NSC 16146 TNM TETRANITROMETHANE 四硝基甲烷 tetranitromethane0 rcrawastenumberp112 Tetan
CAS Number509-14-8
PubChem Substance ID24900040
EC Number208-094-7
MDL NumberMFCD00007391
Chemical Name Translation四硝基甲烷
Merck Number13,9305
Wiswesser Line NotationWNXNWNWNW
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分类

  • Building Blocks, Chemical Synthesis, Nitro Compounds, Nitrogen Compounds, Organic Building Blocks
  • {uni_hamburg} no charge; 1fragment
  • {SNA} Building Blocks, Chemical Synthesis, Nitro Compounds, Nitrogen Compounds, Organic Building Blocks

相关文献及参考

  • 1. Y. A. Volkova, et al., , A simple nitration of electrophilic alkenes with tetranitromethane in the presence of triethylamine. Synthesis of functionalized ß-nitroalkenes Tetrahedron Lett. 52 , 2910-2913, (2011)
  • 2. M. Luethy, et al., , Synthesis of Unusual Oxime Ethers by Reaction of Tetranitromethane with B-Alkylcatecholboranes Chem. Eur. J. 16 , 10171-10177, (2010)
  • 3. Y. A. Volkova, et al., , Unexpected heterocyclization of electrophilic alkenes by tetranitromethane in the presence of triethylamine. synthesis of 3-nitroisoxazoles J. Org. Chem. 75 , 3047-3052, (2010)
  • 4. Y. A. Volkova, et al., , Ring opening of aziridines with tetranitromethane in the presence of triethylamine. Efficient synthesis of ß-tosylamino nitrates Tetrahedron Lett. 51 , 2254-2257, (2010)
  • 5. D. Mitoraj, et al., , Mechanism of aerobic visible light formic acid oxidation catalyzed by poly(tri-s-triazine) modified titania Photochem. Photobiol. 9 , 31-38, (2010)
  • 6. Y. A. Volkova, et al., , Unusual reactions of vinyl ketones with tetranitromethane. The synthesis of 5-acyl-3-nitroisoxazoles Russ. Chem. Bull. 57 , 2034-2035, (2008)
  • 7. Tetrahedron Lett. 34 , 1859, (1993)
  • 8. J. Chem. Soc., Perkin Trans. II , 1719, (1994)
  • 9. Synthesis , 1057, (1993)
  • Merck 14 ,9233
  • Beil. 1 ,80
  • Fieser 1 ,1147 / Fieser 2 ,404 / Fieser 10 ,392
  • Aldrich MSDS 1 , 1688:A / Corp MSDS 1 (2), 3305:C / FT-IR 2 (1), 637:D / FT-IR 1 (1), 398:D / IR-Spectra (3), 235:A / IR-Spectra (2), 209:A / RegBook 1 (1), 441:F / Sax 6 , 2549 / Sigma FT-IR 1 (2), 918:C / Structure Index 1 , 63:C:9 / Vapor Phase 3 , 485:D
  • Short: II/25B Title: Structure Data Of Free Polyatomic Molecule

安全信息

GHS Symbol
WGK Germany3
Hazard Codes O,T+
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H330 Fatal if inhaled 吸入致命
  • H301 Toxic if swallowed 吞食有毒
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
  • H351 Suspected of causing cancer 怀疑致癌
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H271 May cause fire or explosion; strong oxidizer 可能会引起火宅或爆炸；强氧化剂。
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSPB4025000
Precautionary statements
  • 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。
  • P220 Keep/Store away from clothing/…/combustible materials. 保持远离/贮存远离服装/....../可燃材料。
  • P284 Wear respiratory protection.? 佩戴呼吸保护装置。
  • P305+P351+P338
  • P301+P310
  • P281 Use personal protective equipment as required. 使用所需的个人防护装备。
Signal word Danger
Packing GroupI
Hazard Class5.1
Storage condition 2-8°C
UN Number UN 1510 5.1/PG 1
Safety Statements
  • 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）；
  • S28 After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) 皮肤接触后，立即用大量…（由生产厂家指定）冲洗；
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
  • S17 Keep away from combustible material 远离可燃物料；
Risk Statements
  • R26 Very toxic by inhalation 吸入极毒
  • R25 Toxic if swallowed 吞咽有毒
  • R8 Contact with combustible material may cause fire 遇到易燃物会导致起火
  • R40 Limited evidence of a carcinogenic effect 有限证据表明其致癌作用
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Restrict 剧毒化学品
Warnings 危化品目录(2015) 危险化学品 
TYPE OF TEST            : TC - Toxic concentration (other than lowest)
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 500 ppb/6H/2Y-I
TOXIC EFFECTS :
   Tumorigenic - Carcinogenic by RTECS criteria
   Lungs, Thorax, or Respiration - bronchiogenic carcinoma
REFERENCE :
   CALEDQ Cancer Letters (Shannon, Ireland).  (Elsevier Scientific Pub. Ireland
   Ltd., POB 85, Limerick, Ireland)  V.1-    1975- Volume(issue)/page/year:
   57,95,1991

TYPE OF TEST            : TCLo - Lowest published toxic concentration
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 2 ppm/6H/2Y-I
TOXIC EFFECTS :
   Tumorigenic - Carcinogenic by RTECS criteria
   Lungs, Thorax, or Respiration - tumors
   Lungs, Thorax, or Respiration - bronchiogenic carcinoma
REFERENCE :
   NTPTR* National Toxicology Progra

{h

TYPE OF TEST            : TC - Toxic concentration (other than lowest)
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 2 ppm/6H/2Y-I
TOXIC EFFECTS :
   Tumorigenic - Carcinogenic by RTECS criteria
   Lungs, Thorax, or Respiration - bronchiogenic carcinoma
REFERENCE :
   CALEDQ Cancer Letters (Shannon, Ireland).  (Elsevier Scientific Pub. Ireland
   Ltd., POB 85, Limerick, Ireland)  V.1-    1975- Volume(issue)/page/year:
   57,95,

TYPE OF TEST            : TCLo - Lowest published toxic concentration
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 500 ppb/6H/2Y-I
TOXIC EFFECTS :
   Tumorigenic - Carcinogenic by RTECS criteria
   Lungs, Thorax, or Respiration - tumors
   Lungs, Thorax, or Respiration - bronchiogenic carcinoma
REFERENCE :
   NTPTR* National Toxicology Program Technical Report Series.  (Research
   Triangle Park, NC 27709) No.206-  Volume(issue)/page/year: NTP-TR-386,1990

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 12600 ug/kg
TOXIC EFFECTS :
   Blood - methemoglobinemia-carboxyhemoglobin
REFERENCE :
   AMRL** Aerospace Medical Research Laboratory Report.  (Aerospace Technical
   Div., Air Force Systems Command, Wright-Patterson Air Force Base, OH 45433)
   Volume(issue)/page/year: TR-77-25,1977

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 375 mg/kg
TOXIC EFFECTS :
   Sense Organs and Special Senses (Olfaction) - effect, not otherwise
   specified
   Sense Organs and Special Senses (Eye) - effect, not otherwise specified
   Behavioral - somnolence (general depressed activity)
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: AD-A051-334

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 53 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   KHFZAN Khimiko-Farmatsevticheskii Zhurnal.  Chemical Pharmaceutical Journal.
    For English translation, see PCJOAU.  (V/O Mezhdunarodnaya Kniga, 113095
   Moscow, USSR)  V.1-    1967-  Volume(issue)/page/year: 10(6),53,1976

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 63100 ug/kg
TOXIC EFFECTS :
   Blood - methemoglobinemia-carboxyhemoglobin
REFERENCE :
   AMRL** Aerospace Medical Research Laboratory Report.  (Aerospace Technical
   Div., Air Force

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Escherichia coli
DOSE/DURATION           : 500 ug/plate
REFERENCE :
   SAIGBL Sangyo Igaku.  Japanese Journal of Industrial Health.  (Nippon Sangyo
   Eisei Igakkai, Kosu Eisei Bldg., 1-29-8, Shinjuku, Shinjuku-ku, Tokyo 160,
   Japan)  V.1-    1959-  Volume(issue)/page/year: 29,34,1987

TYPE OF TEST            : Sister chromatid exchange
TEST SYSTEM             : Rodent - hamster Ovary
DOSE/DURATION           : 1700 ug/L
REFERENCE :
   NTPTR* National Toxicology Program Technical Report Series.  (Research
   Triangle Park, NC 27709) No.206-  Volume(issue)/page/year: NTP-TR-386,1990

TYPE OF TEST            : Cytogenetic analysis
TEST SYSTEM             : Rodent - hamster Ovary
DOSE/DURATION           : 20 mg/L
REFERENCE :
   NTPTR* National Toxicology Program Technical Report Series.  (Research
   Triangle Park, NC 27709) No.206-  Volume(issue)/page/year: NTP-TR-386,1990

TYPE OF TEST            : DNA damage
TEST SYSTEM             : Rodent - rat Liver
DOSE/DURATION           : 70 umol/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 368,59,1996

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 2 ug/plate
REFERENCE :
   ENMUDM Environmental Mutagenesis.  (New York, NY)  V.1-9, 1979-87.  For
   publisher information, see EMMUEG.  Volume(issue)/page/year: 9(Suppl
   9),1,1987

其他信息

  • 上游原料:硝酸
  • 方法一:将浓硝酸搅拌却，慢慢加入乙酐。加毕，继续搅拌15min，经降温后继续升温，在此5℃下搅拌12-14h，然后用3倍水稀释分出粗品，用硫酸锐水，过滤、担提纯得四硝基甲烷，含量95%。原料消耗（kg/t）乙酐 1800硝酸（95%） 1050无水硫酸钠 700
  • 外观性质:无色液体，有刺激性气味。
  • 毒性分级:高毒
  • 灭火剂:水
  • 爆炸物危险特性:高热、震动、撞击、摩擦可爆
  • 可燃性危险特性:燃烧产生有毒氮氧化物烟雾
  • 急性毒性:口服- 大鼠 LD50: 130 毫克/ 公斤; 口服- 小鼠 LD50: 375 毫克/ 公斤
  • MSDS 信息:四硝基甲烷(509-14-8).msds
  • 储运特性:轻装轻放; 库房通风、远离明火、高温、阳光; 与氧化剂、易燃物分开存放
  • 用途一:用作液体爆炸性混合剂和火箭燃料的氧化剂，制备硝基甲烷的原料。
  • 蒸气压:8.4 mm Hg ( 20 °C)
  • 职业标准:TWA 8 毫克/ 立方米; STEL 24 毫克/ 立方米
  • MOL 文件:509-14-8.mol
  • 类别:爆炸物品
  • Sigma Aldrich:509-14-8(sigmaaldrich)

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Nitro Compounds 硝基化合物

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