东莨菪碱

东莨菪碱 基本信息
CAS号 51-34-3 分子式 C17H21NO4
分子量 303.35300 精确质量 　303.14700
PSA 　62.30000 LogP 　0.85600
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等价的CAS号：

51-34-3,138-12-5,64069-63-2,124917-17-5
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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：
51-34-3
3D弹球模型：
立即前往扯扯看
分子式：
C17H21NO4
分子量：
303.35300
中文名称：
东莨菪碱
英文名称：
scopolamine
中文别名：
东莨菪碱;
9-甲基-3-氧杂-9-氮杂三环[3.3.1.02,4]壬烷-7-醇 (-)-alpha-(羟甲基)苯乙酸酯;
2,4-dinitrophenol, industry grade;
2,4-dinitrophenolate;
2,4-Dinitrophenol;
Fluoracil;
Tegadifure;
Fluorouracil;
1-fluoropyrimidine-2,4(1H,3H)-dione;
Fluorouracil, 5-;
5-fluoro uracil;
5-Fluoro-1H-pyrimidine-2,4-dione;
5-Fluorouracil;
L-Ascorbic Acid;
actinomycin i;
Actinomycin I1;
Actinomycin IV;
Actinomycin-[threo-val-pro-sar-meval];
Actinomycin X 1;
actinomycin x i;
actinomyein-theo-val-pro-sar-meval;
ACTO-D;
AD;
Dilactone actinomycindioic D acid;
Dilactone actinomycin D acid;
C1;
Cosmegen;
Dactinomycin D;
dactinomyein d;
2-amino-4,6-dimethyl-3-oxo-N,N'-bis[2,5,9-trimethyl-1,4,7,11,14-pentaoxo-6,13-di(propan-2-yl)hexadecahydro-1H-pyrrolo[2,1-i][1,4,7,10,13]oxatetraazacyclohexadecin-10-yl]-3H-phenoxazine-1,9-dicarboxamide;
2-amino-4,6-dimethyl-3-oxo-N,N'-bis[2,5,9-trimethyl-6,13-bis(1-methylethyl)-1,4,7,11,14-pentaoxooctadecahydrocyc;
Dactinomycin;
Calciferolum;
Calciferon 2;
Calderol;
Condacaps;
Condol;
Crtron;
Crystallina;
Daral;
Davitamon D;
Davitin;
Decaps;
Dee-osterol;
Deratol;
Dee-ron
英文别名：
scopolamine;
Scopoderm TTS;
(−)-Scopolamine;
1-METHYL-3-NONYLIMIDAZOLIUM BROMIDE, 99%;
scopadulcic acid B
精确分子量/精确质量：
303.14700
极性分子表面积/PSA：
62.30000
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：
200-090-3
InChI：
InChI=1/C9H10O3.C8H13NO2/c10-6-8(9(11)12)7-4-2-1-3-5-7;1-9-5-2-4(10)3-6(9)8-7(5)11-8/h1-5,8,10H,6H2,(H,11,12);4-8,10H,2-3H2,1H3

物化性质展开↓

密度：
1.31
熔点：
59ºC
沸点：
460.3ºC at 760 mmHg
闪点：
232.2ºC
存储条件/存储方法：
库房低温,通风,干燥

安全信息展开↓

危险类别码：
R26/27/28
安全说明：
25-45
危险标志：
T+

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毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
VR3675000
CHEMICAL NAME :
Scopolamine
CAS REGISTRY NUMBER :
51-34-3
LAST UPDATED :
199710
DATA ITEMS CITED :
22
MOLECULAR FORMULA :
C17-H21-N-O4
MOLECULAR WEIGHT :
303.39
WISWESSER LINE NOTATION :
T C356 A AN DOTJ A1 HOVYR&1Q

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Human
DOSE/DURATION :
2 ug/kg
TOXIC EFFECTS :
Brain and Coverings - changes in surface EEG Behavioral - hallucinations, distorted perceptions Behavioral - excitement
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Human - man
DOSE/DURATION :
14 ug/kg
TOXIC EFFECTS :
Behavioral - hallucinations, distorted perceptions Behavioral - ataxia
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Human - woman
DOSE/DURATION :
13 ug/kg
TOXIC EFFECTS :
Behavioral - hallucinations, distorted perceptions Behavioral - ataxia
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intramuscular
SPECIES OBSERVED :
Human - man
DOSE/DURATION :
24 ug/kg
TOXIC EFFECTS :
Behavioral - hallucinations, distorted perceptions
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intramuscular
SPECIES OBSERVED :
Human
DOSE/DURATION :
4 ug/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - mydriasis (pupillary dilation) Behavioral - hallucinations, distorted perceptions
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
2650 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 :
1275 mg/kg
TOXIC EFFECTS :
Behavioral - tremor Behavioral - rigidity (including catalepsy)
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
400 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - effect, not otherwise specified Behavioral - excitement Behavioral - irritability
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1700 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 :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
75 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
50 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 :
Intraperitoneal
DOSE :
1 mg/kg
SEX/DURATION :
female 13 day(s) after conception
TOXIC EFFECTS :
Reproductive - Effects on Newborn - biochemical and metabolic Reproductive - Effects on Newborn - behavioral
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Parenteral
DOSE :
50600 ug/kg
SEX/DURATION :
female 6-16 day(s) after conception
TOXIC EFFECTS :
Reproductive - Effects on Embryo or Fetus - fetal death
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Parenteral
DOSE :
649 mg/kg
SEX/DURATION :
female 6-16 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - post-implantation mortality (e.g. dead and/or resorbed implants per total number of implants)

MUTATION DATA

TYPE OF TEST :
Sister chromatid exchange
TEST SYSTEM :
Human Lymphocyte
DOSE/DURATION :
1 mg/L
REFERENCE :
CMJODS Chinese Medical Journal (Beijing, English Edition). (China International Book Trading Corp., POB 2820, Beijing, Peop. Rep. China) V.1- 1975- Adopted vol. no. 92 in 1979. Volume(issue)/page/year: 101,339,1988 *** REVIEWS *** TOXICOLOGY REVIEW CLANA4 Clinical Anesthesia. (Philadelphia, PA 19103) V.1-11, 1963-76. Volume(issue)/page/year: 10(Pt 1),11,1973 TOXICOLOGY REVIEW DPIRDU Dangerous Properties of Industrial Materials Report. (Van Nostrand Reinhold, 115 Fifth Ave., New York, NY 10003) V.1- 1981- Volume(issue)/page/year: 2(3),16,1982

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