对氯苯丁胺

对氯苯丁胺 基本信息
CAS号 461-78-9 分子式 C10H14ClN
分子量 183.67800 精确质量 　183.08100
PSA 　26.02000 LogP 　3.32010
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目录
基本信息 物化性质 安全信息 合成路线 毒性 上下游

基本信息 展开↓

CAS号：
461-78-9
3D弹球模型：
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分子式：
C10H14ClN
分子量：
183.67800
中文名称：
对氯苯丁胺
英文名称：
1-(4-chlorophenyl)-2-methylpropan-2-amine
中文别名：
对氯苯丁胺;
1-(4-氯苯基)-2-甲基-2-丙胺
英文别名：
1-(4-chlorophenyl)-2-methylpropan-2-amine;
Lucofen SA;
Chlorphenterminum [INN-Latin];
Effox;
Chlorphenterminum;
Clorfentermina [INN-Spanish];
3-(4-chlorophenyl)-2-methyl-2-propylamin;
Clorfentermina;
Teramine;
chlorophentermine;
chlorphentermine;
Desopimon;
1,1-dimethyl-2-(4-chlorophenyl)ethylamine
精确分子量/精确质量：
183.08100
极性分子表面积/PSA：
26.02000
油水分配系数/LogP：

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值，反映了物质在油水两相中的分配情况。其中、LogP值越大，说明该物质越亲油；反之，LogP值越小，则说明该物质越亲水。
EINECS：
207-314-9
InChI：
The Key: ZCKAMNXUHHNZLN-UHFFFAOYSA-N

物化性质展开↓

密度：
1.074g/cm3
沸点：
255.8ºC at 760mmHg
闪点：
127ºC
折射率：
1.537
蒸汽压：
0.016mmHg at 25°C

安全信息展开↓

海关代码：
29222900

合成路线查看所有的合成路线

  • 52449-43-1

    对氯苯乙酸甲酯

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  • 461-78-9

    对氯苯丁胺

  • 104-83-6

    4-氯氯苄

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  • 461-78-9

    对氯苯丁胺

  • 78558-98-2

    N-Formyl-1,2,3,7,8,12b-hexahydrobenzo<6.7>cyclohepta<1.2.3-d.e>isochinolin

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  • 461-78-9

    对氯苯丁胺

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SH1050000
CHEMICAL NAME :
Phenethylamine, p-chloro-alpha,alpha-dimethyl-
CAS REGISTRY NUMBER :
461-78-9
BEILSTEIN REFERENCE NO. :
1099928
LAST UPDATED :
199709
DATA ITEMS CITED :
15
MOLECULAR FORMULA :
C10-H14-Cl-N
MOLECULAR WEIGHT :
183.70
WISWESSER LINE NOTATION :
ZX1&1&1R DG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Human - man
DOSE/DURATION :
5357 ug/kg
TOXIC EFFECTS :
Autonomic Nervous System - sympathomimetic Vascular - BP elevation not characterized in autonomic section
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
250 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
270 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Behavioral - excitement Lungs, Thorax, or Respiration - respiratory stimulation
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
150 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
260 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Behavioral - excitement Lungs, Thorax, or Respiration - respiratory stimulation
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
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1800 mg/kg/30D-I
TOXIC EFFECTS :
Behavioral - food intake (animal) Behavioral - fluid intake Nutritional and Gross Metabolic - weight loss or decreased weight gain
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
720 mg/kg/6W-I
TOXIC EFFECTS :
Vascular - BP lowering not characterized in autonomic section Lungs, Thorax, or Respiration - changes in pulmonary vascular resistance Lungs, Thorax, or Respiration - other changes
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1800 mg/kg/15W-I
TOXIC EFFECTS :
Vascular - BP lowering not characterized in autonomic section Lungs, Thorax, or Respiration - changes in pulmonary vascular resistance Lungs, Thorax, or Respiration - other changes
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1800 mg/kg/6W-I
TOXIC EFFECTS :
Vascular - BP lowering not characterized in autonomic section Lungs, Thorax, or Respiration - other changes Nutritional and Gross Metabolic - weight loss or decreased weight gain
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
3900 mg/kg/13W-I
TOXIC EFFECTS :
Vascular - BP lowering not characterized in autonomic section Lungs, Thorax, or Respiration - changes in pulmonary vascular resistance Lungs, Thorax, or Respiration - other changes
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
480 mg/kg
SEX/DURATION :
female 10-21 day(s) after conception
TOXIC EFFECTS :
Reproductive - Effects on Embryo or Fetus - cytological changes (including somatic cell genetic material) Reproductive - Specific Developmental Abnormalities - immune and reticuloendothelial system
TYPE OF TEST :
Unscheduled DNA synthesis

MUTATION DATA

TEST SYSTEM :
Rodent - rat
DOSE/DURATION :
300 mg/kg/5D (Continuous)
REFERENCE :
40QBA3 "Proceedings of the International Congress on Toxicology, Toxicology as a Predictive Science, 1st, Toronto, 1977," Plaa, G.L., and W.A. Duncan, eds., New York, Academic Press, Inc., 1978 Volume(issue)/page/year: -,459,1978 *** REVIEWS *** TOXICOLOGY REVIEW FEPRA7 Federation Proceedings, Federation of American Societies for Experimental Biology. (Bethesda, MD) V.1-46, 1942-87. Volume(issue)/page/year: 35,89,1976

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