cas号： 143-98-6 ，名称：去甲右美沙芬酒石酸盐的性质/作用/用途-化学加百科

去甲右美沙芬酒石酸盐

去甲右美沙芬酒石酸盐基本信息
CAS号	143-98-6	分子式	C21H29NO7
分子量	407.45700	精确质量	407.19400
PSA	138.53000	LogP	0.89570

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等价的CAS号：

125-72-4,143-98-6,4573-87-9,25126-36-7

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基本信息物化性质安全信息毒性结构与计算数据

基本信息展开↓

CAS号：: 143-98-6
3D弹球模型：: 立即前往扯扯看
分子式：: C21H29NO7
分子量：: 407.45700
中文名称：: 去甲右美沙芬酒石酸盐
英文名称：: Dextrorphan tartrate
中文别名：: 去甲右美沙芬酒石酸盐;
(+)-3-Hydroxy-N-methylmorphinan (+)-tartrate salt Dextrorphan D-tartrate
英文别名：: Dextrorphan tartrate;
17-Methyl-morphinan-3-ol,Lg-Hydrogentartrat;
d-3-Hydroxy-N-methylmorphinan tartrate;
Dextrorphan Tartrate Salt;
Levorphanol tartrate;
1,3,4,9,10,10a-Hexahydro-11-methyl-2H-10,4a-iminoethanophenanthren-6-ol tartrate,d;
Dextrophan tartrate;
17-methyl-morphinan-3-ol,Lg-hydrogentartrate
精确分子量/精确质量：: 407.19400
极性分子表面积/PSA：: 138.53000
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。
贝尔斯坦号/MDL：: MFCD00151495
PubChem：: 24277974
InChI：: The Key: RWTWIZDKEIWLKQ-DYWKTHLTSA-N

物化性质展开↓

沸点：: 410.4ºC at 760 mmHg
闪点：: 207.2ºC
蒸汽压：: 2.55E-07mmHg at 25°C
存储条件/存储方法：: −70℃

安全信息展开↓

危险类别码：: R22
危险标志：: Xn

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :: QD1930000

CAS REGISTRY NUMBER :: 143-98-6

LAST UPDATED :: 199106

DATA ITEMS CITED :: 7

MOLECULAR FORMULA :: C17-H23-N-O.C4-H6-O6

MOLECULAR WEIGHT :: 407.51

WISWESSER LINE NOTATION :: T6 G666/FQ 2AF Q FX ONT&TTJ IQ O &622 QVYQYVQ -D &621

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 :: 1100 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 109,189,1953

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 800 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 109,189,1953

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 385 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 109,189,1953

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 350 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 109,189,1953

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 42 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: 31ZPAG "Synthetic Analgesics," Oxford, Pergamon Press, 1966 Volume(issue)/page/year: 2,77,1966

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Parenteral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 17414 ug/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 145,11,1964

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - rabbit

DOSE/DURATION :: 27500 ug/kg

TOXIC EFFECTS :: Behavioral - muscle weakness Behavioral - rigidity (including catalepsy) Lungs, Thorax, or Respiration - dyspnea

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 109,189,1953

分子结构与计算化学数据展开↓

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:5

3.氢键受体数量:8

4.可旋转化学键数量:3

5.互变异构体数量:3

6.拓扑分子极性表面积139

7.重原子数量:29

8.表面电荷:0

9.复杂度:491

10.同位素原子数量:0

11.确定原子立构中心数量:5

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:2