苯甲托品

苯甲托品 基本信息
CAS号 86-13-5 分子式 C21H25NO
分子量 307.42900 精确质量  307.19400
PSA  12.47000 LogP  4.35570

基本信息 展开↓

CAS号:
86-13-5
3D弹球模型:
立即前往扯扯看
分子式:
C21H25NO
分子量:
307.42900
中文名称:
苯甲托品
英文名称:
benzatropine
中文别名:
苯甲托品
英文别名:
benzatropine;
Benaztropine;
benzotropine;
exo-Benztropine;
tropine benzohydryl ether
精确分子量/精确质量:
307.19400
极性分子表面积/PSA:
12.47000
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。
InChI:
The Key: GIJXKZJWITVLHI-PMOLBWCYSA-N

物化性质展开↓

密度:
1.11g/cm3
沸点:
409ºC at 760 mmHg
闪点:
120.1ºC
折射率:
1.604
存储条件/存储方法:
通风低温干燥,与库房食品原料分开存放

合成路线查看所有的合成路线

  • 797763-49-6

    3α-benzhydryloxy-8-azabicyclo[3.2.1]octane-8-carboxylic acid methyl ester

  • ~82%

  • 86-13-5

    苯甲托品

  • 908093-98-1

    908093-98-1

  • +

  • 120-29-6

    托品醇

  • 86-13-5

    苯甲托品

  • 776-74-9

    二苯基溴甲烷

  • +

  • 120-29-6

    托品醇

  • 86-13-5

    苯甲托品

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YM3100000
CHEMICAL NAME :
1-alpha-H,5-alpha-H-Tropane, 3-alpha-(diphenylmethoxy)-
CAS REGISTRY NUMBER :
86-13-5
LAST UPDATED :
199709
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C21-H25-N-O
MOLECULAR WEIGHT :
307.47
WISWESSER LINE NOTATION :
T56 A ANTJ A1 GOYR&R -ALL ALPHA

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
60 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - mydriasis (pupillary dilation) Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - other changes
REFERENCE :
JMPCAS Journal of Medicinal and Pharmaceutical Chemistry. (Washington, DC) V.1-5, 1959-62. For publisher information, see JMCMAR. Volume(issue)/page/year: 4,215,1961
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
25 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - mydriasis (pupillary dilation) Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - other changes
REFERENCE :
JMPCAS Journal of Medicinal and Pharmaceutical Chemistry. (Washington, DC) V.1-5, 1959-62. For publisher information, see JMCMAR. Volume(issue)/page/year: 4,215,1961 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X3957 No. of Facilities: 7 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 103 (estimated) No. of Female Employees: 52 (estimated)

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  • 797763-49-6

    3α-benzhydryloxy-8-azabicyclo[3.2.1]octane-8-carboxylic acid methyl ester

  • 797763-48-5

    3α-benzhydryloxy-8-azabicyclo[3.2.1]octane-8-carboxylic acid tert-butyl ester

  • 538-09-0

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  • 120-29-6

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