2,4,5-Trichlorophenol 2,4,5-三氯苯酚

CAS 95-95-4 MFCD00002170

化学结构图

95-95-4
SMILES: Oc1cc(Cl)c(Cl)cc1Cl

化学属性

Mol. FormulaC6H3Cl3O
Mol. Weight197
Boiling Point115°C/10mmHg(lit.)
Melting Point64.0 to 68.0 deg-C
Density1.678
TSCAYes
Flash Point133°(271°F)
Stability易吸潮
Solubility不溶于水,溶于四氯化碳、醇、苯、醚。

别名和识别编码

Chemical Name2,4,5-Trichlorophenol
CAS Number95-95-4
Alfabeta NameTRICHLOROPHENOL 245-,,
MDL NumberMFCD00002170
PubChem Substance ID7271
EC Number202-467-8
Beilstein Registry Number6(2)180
Reaxys-RN607569
Merck Number9643
Synonym {uni_hamburg} caswellno.879 2,4,5-trichloro-phenol DOWICIDE 2 Preventol I 2,4,5-TRICHLOROPHENOL 2,4,5-TRICHLOROPHENOL PESTANAL, 250 MG epapesticidechemicalcode064210 Dowicide 2 2,4,5-TRICHLOROPHENOL MINIMUM 99% NCI-C61187 2,4,5-三氯苯酚 phenol, 2,4,5-trichloro- 5-三氯苯酚 2,4,5-三氯酚 2,4,5-trichlorophenolsaltof2,6-bis((dimethylamino)methyl)cyclohexanone 2 Collunosol Rcra waste number U230 2,4,5-三氯酚 Nurelle Dowcide 2 5-三氯酚 2,4,5-trichloro-pheno preventoli 2,4,5-三氯苯酚;2,4,5-三氯酚 2,4,5-Trichlorphenol 4 COLLUNOSOL 2,4,5-三氯苯酚, 98+% TCP 2,4,5-tcp 2,4,5-TRICHLOROPHENOL, 1X1ML, MEOH, 5000 UG/ML 2,4,5-三氯苯酚, 95+% RCRA waste number U230 rcrawastenumberu230 2,4,5-Trichlorophenol DOWICIDE 2(R) 2,4,5-TRICHLORO-1-HYDROXY-BENZENE 2.4,5-Trichlorophenic acid 2,4,5-trichlorophenol
Chemical Name Translation2,4,5-三氯苯酚
Wiswesser Line NotationQR BG CG EG
LabNetwork Molecule IDLN00173640
InChIInChI=1S/C6H3Cl3O/c7-3-1-5(9)6(10)2-4(3)8/h1-2,10H
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分类

  • {SNA} Alphabetical
  • {SNA} Building Blocks, C6 to C8, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds, Phenols
  • {SNA} Alphabetical Index of Analytical Standards, Analytical Standards, Analytical/Chromatography, Chromatography, Environmental Standards, Q-Z, T, TP - TZ, 农残和代谢标准品, 按照字母排序
  • {SNA} All alphabetically sorted, Alphabetical Index of Analytical Standards, Analytical Standards, Analytical/Chromatography, Chromatography, Environmental Standards, Pesticides & Metabolites, Q-Z, T,

产品应用

  • 用作杀霉菌剂、气相色谱对比样品。

相关文献及参考

  • Merck: 14,9643 Beilstein:6(2)180
  • Short: III/20a
  • 2,4,5-Trichlorophenyl esters are more reactive than p-nitrophenyl esters in peptide coupling: Helv. Chim. Acta, 46, 1609 (1963); J. Chem. Soc., 6130 (1964). See Appendix 6.
  • Merck: 14,9643
  • Short: III/35D2

安全信息

Warnings IRRITANT 危化品目录(2015) 危险化学品
GHS Symbol
WGK Germany3
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H315 Causes skin irritation 会刺激皮肤
  • H410 Verytoxictoaquaticlifewithlonglastingeffects 对水生生物毒性非常大并具有长期影响。
  • H319 Causes serious eye irritation 严重刺激眼睛
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes
RTECSSN1400000
Precautionary statements
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • P273 Avoid release to the environment. 避免释放到环境中。
  • P391 Collect spillage. Hazardous to the aquatic environment 收集对水环境有危害的泄漏物。
  • P301+P312+P330
  • P305+P351+P338
  • 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。
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • 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
  • P302+P350
  • P337+P313
  • P308+P313
  • P302+P352+P332+P313+P362+P364
Signal word
UN Number UN 3077 9/PG 3 2020 UN2020 3077
Safety Statements
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R36/38 Irritating to eyes and skin 对眼睛和皮肤有刺激性
  • R22 Harmful if swallowed 吞咽有害
  • R50/53
  • R39/23/24/25 Toxic: danger of very serious irreversible effects through inhalation, in contact with skin and if swallowed 毒性:吸入,皮肤接触和吞食都会产生十分严重的不可逆危险
  • R23/24/25 Toxic by inhalation, in contact with skin and if swallowed 吸入,皮肤接触及吞食都有毒
  • R11 Highly flammable 非常易燃
  • R52/53
Packing GroupIII
Storage condition 易吸潮 储存温度2-8℃ 0-6°C
Hazard Class6.1
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 6700 mg/kg/16W-I
TOXIC EFFECTS :
   Tumorigenic - neoplastic by RTECS criteria
   Skin and Appendages - tumors
REFERENCE :
   CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut
   Sts., Philadelphia, PA 19106)  V.1-    1941-  Volume(issue)/page/year:
   19,413,1959

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 820 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FEPRA7 Federation Proceedings, Federation of American Societies for
   Experimental Biology. (Bethesda, MD)  V.1-46, 1942-87.
   Volume(issue)/page/year: 2,76,1943

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 56 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#03492

TYPE OF TEST            :

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - guinea pig
DOSE/DURATION           : 1 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FMCHA2 Farm Chemicals Handbook.  (Meister Pub., 37841 Euclid Ave.,
   Willoughy, OH 44094)  Volume(issue)/page/year: -,C310,1991

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 355 mg/kg
TOXIC EFFECTS :
   Behavioral - tremor
   Behavioral - convulsions or effect on seizure threshold
   Nutritional and Gross Metabolic - body temperature increase
REFERENCE :
   BJPCAL British Journal of Pharmacology and Chemotherapy.  (London, UK)
   V.1-33, 1946-68.  For publisher information, see BJPCBM.
   Volume(issue)/page/year: 13,20,1958

TYPE OF TEST            : Cytogenetic analysis
TEST SYSTEM             : Rodent - hamster Ovary
DOSE/DURATION           : 150 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 303,101,1993

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 10 ug/plate
REFERENCE :
   TECSDY Toxicological and Environmental Chemistry.  (Gordon & Breach Science
   Pub. Inc., 1 Park Ave., New York, NY 10016)  V.3(3/4)-    1981-
   Volume(issue)/page/year: 14,143,1987

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 4 gm/kg
SEX/DURATION            : female 8-12 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Effects on Newborn - live birth index (measured after birth)
REFERENCE :
   JTEHD6 Journal of Toxicology and Environmental Health.  (Hemisphere Pub.,
   1025 Vermont Ave., NW, Washington, DC 20005)  V.1-    1975/76-
   Volume(issue)/page/year: 10,541,1982

其他信息

  • 可燃性危险特性:可燃; 燃烧释放有毒氯化物烟雾
  • 方法一:将2,3,5,6-四氯苯、固碱、甲醇投入高压釜,控制温度在135-152℃,压力为0.5-1.4MPa,保持14h。将反应液冷至60℃,蒸馏回收甲醇,放出残液,冷却结晶,过滤。将结晶溶于水,加热至70℃,加入保险粉,调节pH=9.2-9.6,加入活性炭,于95℃脱色半小时。过滤,滤液冷至15℃以下,加盐酸至pH=2-3,滤取2,4,5-三氯酚,于45℃干燥得成品。
  • 外观性质:无色针状结晶或灰色片状物,有强烈的苯酚气味。
  • MOL 文件:95-95-4.mol
  • 图谱信息:2,4,5-三氯苯酚(95-95-4)核磁图( 1 HNMR) 2,4,5-三氯苯酚(95-95-4)质谱(MS) 2,4,5-三氯苯酚(95-95-4)核磁图( 13 CNMR) 2,4,5-三氯苯酚(95-95-4)红外图谱(IR2) 2,4,5-三氯苯酚(95-95-4)红外图谱(IR1) 2,4,5-三氯苯酚(95-95-4)红外图谱(IR3)
  • 有强烈的苯酚气味,不溶于水,溶于四氯化碳、醇、苯、醚。蒸汽压0.133kPa(72℃)
  • TCI Shanghai:2,4,5-三氯苯酚 2,4,5-Trichlorophenol,>;95.0%(GC)(95-95-4)
  • Sigma Aldrich:95-95-4(sigmaaldrich)
  • 2,4,5-三氯苯酚价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 T0389 2,4,5-三氯苯酚 2,4,5-Trichlorophenol 500G 3890元 2014/06/02 T0389 2,4,5-三氯苯酚 2,4,5-Trichlorophenol 25G 423元 2010/05/25 43737 2,4,5-三氯苯酚, 95+% 2,4,5-Trichlorophenol, 96% 25g 382元
  • 毒性分级:中毒
  • 急性毒性:口服-大鼠 LD50: 820 毫克/公斤; 口服-小鼠LD50: 600 毫克/公斤
  • 下游产品:六氯芬 --> 2,4,5-三氯苯基-Β-丙炔醚 --> 氯丙炔碘 --> 皮蝇磷
  • Alfa Aesar:2,4,5-三氯苯酚,98+% 2,4,5-Trichlorophenol, 98%(95-95-4)
  • 类别:农药
  • MSDS 信息:2,4,5-三氯苯酚(95-95-4).msds
  • 用途二:用作杀霉菌剂、气相色谱对比样品。
  • 酚类单一化合物标准液
  • 储运特性:库房通风低温干燥; 与酸类、氧化剂、食品添加剂分开存放
  • 灭火剂:雾状水、泡沫、二氧化碳、砂土。
  • 职业标准:TWA 0.5 毫克/立方米
  • 用途一:可用于制备多种除草剂、杀虫剂、杀菌剂;作为抗菌和防腐剂,广泛用于制备粘合剂、橡胶制品及纺织工业的防腐乳液。它本身可用作消毒剂,它的钠盐也是杀菌剂和防腐剂,用于制造业和皮革工业;在医药上用于合成氯丙炔碘、灭菌酚等。
  • 爆炸物危险特性:高温分解可爆炸
  • 上游原料:氢氧化钠 --> 硫酸 --> 甲苯 --> 连二亚硫酸钠 --> 丙二醇 --> 四硼酸钠 --> 1,2,4,5-四氯苯 --> 1,2,3,5-四氯苯

系列性分类


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