左洛啡烷

  • 基本信息
  • 物化性质
  • 毒理性
  • 结构与计算化学

左洛啡烷 基本信息

中文名称:
左洛啡烷 
中文别名:
左洛啡烷 
英文名称:
Morphinan-3-ol,17-(2-propen-1-yl)-
英文别名:
levallorphan;
Lorfan;
Levallorphane [INN-French];
Levalorfano;
Levallorphanum;
Levallorphane;
Naloxiphan;
Levalorfano [INN-Spanish];
17-allyl-morphinan-3-ol;
Levallofano [DCIT] 
CAS No.:
152-02-3
分 子 式:

C19H25NO

分 子 量:
283.41
精确分子量:
283.19400
PSA:
23.47000
EINECS:
205-799-1
InChI:
The Key: OZYUPQUCAUTOBP-QXAKKESOSA-N
危险品标志:

 

风险术语:

 

安全术语:
分子结构式:
SDS:
查看

左洛啡烷 物化性质

密度:
1.14g/cm3
沸点:
433.5ºC at 760mmHg
闪点:
214.2ºC
折射率:
1.614
蒸汽压:
4.02E-08mmHg at 25°C
存储条件/存储方法:
库房通风低温干燥,与食品原料分开存放

左洛啡烷 毒理性

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)
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。

左洛啡烷 分子结构与计算化学数据

分子结构数据

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

计算化学数据

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

推荐供应商更多供应商>>

QQ: 2241752642
微信二维码
电话: 19906633110