2,2'-Dichlorobiphenyl
- 中文别名:2,2-二氯联苯
- 中文释义:2,2’-二氯联苯;多氯联苯;2,2\'-二氯联苯;2,2-二氯联苯
- 英文别名:1,1'-Biphenyl, 2,2'-dichloro-;
2,2'-Dichlorobiphenyl;
1-chloro-2-(2-chlorophenyl)benzene
- CAS No.:13029-08-8
- 分子式:
C12H8Cl2
- 分子量:223.10
- 精确分子量:222.00031
- PSA:0.00 A2
- InChI:The Key: JAYCNKDKIKZTAF-UHFFFAOYSA-N
- 分子结构式:
物化性质
- 密度:
- 1.249±0.06 g/cm3
- 熔点:
- 52-55 °C
- 沸点:
- 289.1±15.0 °C
- 闪点:
- 122.4±13.9 °C
- 水溶解性:
- Sparingly Soluble (7.8E-4 g/L)
- 折射率:
- 1.594
- 蒸汽压:
- 0.00389mmHg at 25°C
- 蒸汽密度:
- 3.89E-3 Torr
安全信息
- 密度:
- 1.249±0.06 g/cm3
- 熔点:
- 52-55 °C
- 沸点:
- 289.1±15.0 °C
- 闪点:
- 122.4±13.9 °C
- 水溶解性:
- Sparingly Soluble (7.8E-4 g/L)
- 折射率:
- 1.594
- 蒸汽压:
- 0.00389mmHg at 25°C
- 蒸汽密度:
- 3.89E-3 Torr
毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- DV3900000
- CHEMICAL NAME :
- Biphenyl, 2,2'-dichloro-
- CAS REGISTRY NUMBER :
- 13029-08-8
- LAST UPDATED :
- 199710
- DATA ITEMS CITED :
- 7
- MOLECULAR FORMULA :
- C12-H8-Cl2
- MOLECULAR WEIGHT :
- 223.10
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 150 mg/kg/3D-I
- TOXIC EFFECTS :
- Biochemical - Enzyme inhibition, induction, or change in blood or tissue levels - other esterases Biochemical - Enzyme inhibition, induction, or change in blood or tissue levels - other Enzymes
- REFERENCE :
- TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 33,94,1975
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 25 mg/kg/20D-I
- TOXIC EFFECTS :
- Immunological Including Allergic - decrease in humoral immune response
- REFERENCE :
- JEPOEC Journal of Environmental Pathology, Toxicology and Oncology. (Chem-Orbital, POB 134, Park Forest, IL 60466) V.5(4)- 1984- Volume(issue)/page/year: 9,283,1989
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Intramuscular
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 25 mg/kg/20D-I
- TOXIC EFFECTS :
- Liver - other changes
- REFERENCE :
- JEPOEC Journal of Environmental Pathology, Toxicology and Oncology. (Chem-Orbital, POB 134, Park Forest, IL 60466) V.5(4)- 1984- Volume(issue)/page/year: 12,17,1993 ** REPRODUCTIVE DATA **
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 1125 mg/kg
- SEX/DURATION :
- female 1-3 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Fertility - post-implantation mortality (e.g. dead and/or resorbed implants per total number of implants) Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus)
- REFERENCE :
- ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 40,249,1978
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 1500 mg/kg
- SEX/DURATION :
- female 1-3 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Fertility - pre-implantation mortality (e.g. reduction in number of implants per female; total number of implants per corpora lutea)
- REFERENCE :
- ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 40,249,1978
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 1125 mg/kg
- SEX/DURATION :
- female 1-3 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Maternal Effects - parturition
- REFERENCE :
- BECTA6 Bulletin of Environmental Contamination and Toxicology. (Springer-Verlag New York, Inc., Service Center, 44 Hartz Way, Secaucus, NJ 07094) V.1- 1966- Volume(issue)/page/year: 16,33,1976
分子结构与计算化学数据
计算化学数据
1.疏水参数计算参考值(XlogP):无
2.氢键供体数量:0
3.氢键受体数量:0
4.可旋转化学键数量:1
5.互变异构体数量:无
6.拓扑分子极性表面积:0
7.重原子数量:14
8.表面电荷:0
9.复杂度:161
10.同位素原子数量:0
11.确定原子立构中心数量:0
12.不确定原子立构中心数量:0
13.确定化学键立构中心数量:0
14.不确定化学键立构中心数量:0
15.共价键单元数量:1
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