1,2,3-Trichlorobenzene
SmallMolecule
T3DB_ID
T3D0116
描述
1,2,3-Trichlorobenzene is an organochloride aromatic compound and one of the three isomeric forms of trichlorobenzene. Trichlorobenzene is used as a solvent. (L223)
类别
"Pesticide", "Industrial/Workplace Toxin", "Synthetic Toxin"
同义词
"1,2, 3-Trichlorobenzene", "1,2,3-Trichlorbenzol", "1,2,6-Trichlorobenzene", "Trichlorbenzene", "Vic-trichlorobenzene"
CAS登记号
87-61-6
化学式
C6H3Cl3
平均分子量
181.447
单同位素质量
179.930033217
IUPAC 名称
1,2,3-trichlorobenzene
传统名称
1,2,3-trichlorobenzene
简化分子线性输入规范
ClC1=CC=CC(Cl)=C1Cl
InChI 标识符
InChI=1S/C6H3Cl3/c7-4-2-1-3-5(8)6(4)9/h1-3H
InChIKey=RELMFMZEBKVZJC-UHFFFAOYSA-N
化合物类型
Organic compounds
大分类
Benzenoids
类型
Benzene and substituted derivatives
子类
Halobenzenes
直接大类
Chlorobenzenes
另外分类
"Aryl chlorides", "Hydrocarbon derivatives", "Organochlorides"
取代基
"Aromatic homomonocyclic compound", "Aryl chloride", "Aryl halide", "Chlorobenzene", "Hydrocarbon derivative", "Organochloride", "Organohalogen compound"
分子框架
Aromatic homomonocyclic compounds
外部描述符
"a small molecule", "trichlorobenzene"
地位
Detected and Not Quantified
起源
Exogenous
蜂窝位置
"Membrane", "Membrane Fraction"
生物流体位置
组织位置
途径
状态
Solid
外貌
White crystals.
熔点/沸点/溶解度
53.5°C//0.018 mg/mL at 25 °C [CHIOU,CT et al. (1986)]
日志P
暴露途径
Oral (T38) ; inhalation (T38) ; dermal (T38)
毒性机制
Trichlorobenzene may uncouple mitochondrial oxidative phosphorylation, inducing potassium ion release and inhibiting respiratory control. It's metabolites may covalently bind to cellular proteins and alkylate DNA. (A154, A155)
代谢
Trichlorobenzene is absorbed via oral, inhalation, and dermal routes. It is believed to be metabolized via cytochrome p-450 enzymes into metabolites that include phenols, mercapturic acid, and catechols.(T38)
毒性值
LD50: 756 mg/kg (Oral, Rat) (T20)
致死剂量
致癌性
No indication of carcinogenicity to humans (not listed by IARC).
用途/来源
Trichlorobenzene is used as a solvent in chemical manufacturing, as well as in dyes, dielectric fluid, synthetic transformer oils, lubricants, heat-transfer medium, and insecticides. (T39)
最低风险等级
健康影响
High levels of trichlorobenzene may damage the liver, kidney, and thyroid. (A153)
症状
Trichlorobenzene irritates the eyes and respiratory tract. (T20)
治疗
药库 ID
HMDB_ID
PubChem 化合物 ID
6895
维基百科链接
创建于
2009-03-06 18:58:06 UTC
更新于
2014-12-24 20:21:08 UTC
目标
毒素T3DB ID毒素名称目标名称
T3D0116 1,2,3-Trichlorobenzene Estrogen receptor beta
T3D0116 1,2,3-Trichlorobenzene Estrogen receptor alpha
T3D0116 1,2,3-Trichlorobenzene Sodium/potassium-transporting ATPase subunit beta-3
T3D0116 1,2,3-Trichlorobenzene Sodium/potassium-transporting ATPase subunit beta-2
T3D0116 1,2,3-Trichlorobenzene Sodium/potassium-transporting ATPase subunit beta-1
T3D0116 1,2,3-Trichlorobenzene Sodium/potassium-transporting ATPase subunit alpha-4
T3D0116 1,2,3-Trichlorobenzene Sodium/potassium-transporting ATPase subunit alpha-3
T3D0116 1,2,3-Trichlorobenzene Sodium/potassium-transporting ATPase subunit alpha-2
T3D0116 1,2,3-Trichlorobenzene Sodium/potassium-transporting ATPase subunit alpha-1
T3D0116 1,2,3-Trichlorobenzene Sodium/potassium-transporting ATPase subunit gamma
T3D0116 1,2,3-Trichlorobenzene Sarcoplasmic/endoplasmic reticulum calcium ATPase 3
T3D0116 1,2,3-Trichlorobenzene Sarcoplasmic/endoplasmic reticulum calcium ATPase 2
T3D0116 1,2,3-Trichlorobenzene Sarcoplasmic/endoplasmic reticulum calcium ATPase 1
T3D0116 1,2,3-Trichlorobenzene Plasma membrane calcium-transporting ATPase 4
T3D0116 1,2,3-Trichlorobenzene Plasma membrane calcium-transporting ATPase 3
T3D0116 1,2,3-Trichlorobenzene Plasma membrane calcium-transporting ATPase 2
T3D0116 1,2,3-Trichlorobenzene Plasma membrane calcium-transporting ATPase 1
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit theta
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit rho-3
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit rho-2
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit rho-1
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit pi
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit gamma-3
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit gamma-2
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit gamma-1
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit epsilon
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit delta
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit beta-3
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit beta-2
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit beta-1
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit alpha-6
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit alpha-5
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit alpha-4
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit alpha-3
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit alpha-2
T3D0116 1,2,3-Trichlorobenzene Gamma-aminobutyric acid receptor subunit alpha-1
T3D0116 1,2,3-Trichlorobenzene Calcium-transporting ATPase type 2C member 2
T3D0116 1,2,3-Trichlorobenzene Calcium-transporting ATPase type 2C member 1
T3D0116 1,2,3-Trichlorobenzene Transient receptor potential cation channel subfamily A member 1
T3D0116 1,2,3-Trichlorobenzene Phosphatidylinositol 3,4,5-trisphosphate 3-phosphatase and dual-specificity protein phosphatase PTEN
T3D0116 1,2,3-Trichlorobenzene 72 kDa type IV collagenase
T3D0116 1,2,3-Trichlorobenzene Retinoic acid receptor gamma-2
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