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152-02-3

152-02-3结构式
152-02-3结构式
  • 常用中文名:左洛啡烷
  • 常用英文名:levallorphan
  • CAS号:152-02-3
  • 分子式:C19H25NO
  • 分子量:283.40800
  • 发布时间:2018-09-28 11:26:26
  • 更新时间:2024-01-06 09:07:15

化源商城直购

中文名 左洛啡烷
英文名 levallorphan
英文别名 EINECS 205-799-1
Lorfan
Levallorphane
Levalorfano [INN-Spanish]
Levallorphanum
Levallorphane [INN-French]
Levalorfano
Levallofano [DCIT]
Naloxiphan
17-allyl-morphinan-3-ol
密度 1.14g/cm3
沸点 433.5ºC at 760mmHg
分子式 C19H25NO
分子量 283.40800
闪点 214.2ºC
精确质量 283.19400
PSA 23.47000
LogP 3.57450
蒸汽压 4.02E-08mmHg at 25°C
折射率 1.614
储存条件

通风低温干燥。

分子结构

1、 摩尔折射率:85.95

2、 摩尔体积(cm3/mol):246.6

3、 等张比容(90.2K):657.1

4、 表面张力(dyne/cm):50.4

5、 极化率(10-24cm3):34.07

计算化学

1.疏水参数计算参考值(XlogP):无

2.氢键供体数量:1

3.氢键受体数量:2

4.可旋转化学键数量:2

5.互变异构体数量:3

6.拓扑分子极性表面积23.5

7.重原子数量:21

8.表面电荷:0

9.复杂度:408

10.同位素原子数量:0

11.确定原子立构中心数量:3

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

毒理学数据:

口服-大鼠LD50: 949毫克/公斤; 腹腔-小鼠LD50: 184 毫克/公斤。

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QD0350000
CHEMICAL NAME :
Morphinan-3-ol, 17-allyl-, (-)-
CAS REGISTRY NUMBER :
152-02-3
LAST UPDATED :
199512
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C19-H25-N-O
MOLECULAR WEIGHT :
283.45
WISWESSER LINE NOTATION :
T6 G666/FQ 2AF Q FX ONT&TTJ IQ O2U1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
949 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
27ZIAQ "Drug Dosages in Laboratory Animals - A Handbook," Rev. ed., Barnes, C.D., and L.G. Eltherington, Berkeley, Univ. of California Press, 1973 Volume(issue)/page/year: -,-,1965
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
185 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
27ZIAQ "Drug Dosages in Laboratory Animals - A Handbook," Rev. ed., Barnes, C.D., and L.G. Eltherington, Berkeley, Univ. of California Press, 1973 Volume(issue)/page/year: -,140,1973
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
184 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
27ZIAQ "Drug Dosages in Laboratory Animals - A Handbook," Rev. ed., Barnes, C.D., and L.G. Eltherington, Berkeley, Univ. of California Press, 1973 Volume(issue)/page/year: -,-,1965
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ANYAA9 Annals of the New York Academy of Sciences. (New York Academy of Sciences, 2 E. 63rd St., New York, NY 10021) V.1- 1877- Volume(issue)/page/year: 281,321,1976 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X4763 No. of Facilities: 7 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 103 (estimated) No. of Female Employees: 52 (estimated)