硫酸长春地辛

硫酸长春地辛 基本信息
CAS号 59917-39-4 分子式 C43H57N5O11S
分子量 852.00500 精确质量 　851.37800
PSA 　247.80000 LogP 　3.80150
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目录
基本信息 制备方法与用途 物化性质 安全信息 毒性

基本信息 展开↓

CAS号：
59917-39-4
3D弹球模型：
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分子式：
C43H57N5O11S
分子量：
852.00500
中文名称：
硫酸长春地辛
英文名称：
vindesine sulfate
中文别名：
硫酸长春地辛;
2-bromo-1-fluoro-3-methylbenzene;
3-Fluoro-2-Bromo Toluene;
4-chloro-2,3-dimethylpyridine 1-oxide;
2,3-Dimethyl-4-chloropyridine-N-oxide;
1,3-双(二苯基磷)丙烷二氯化钯;
1,3-双(二苯基膦)丙烷氯化钯;
双(1,3-二苯基膦)丙基二氯化钯 (II);
5-isobenzofurancarbonitrile,1,3-dihydro-1-(3-(dimethylamino)propyl)-1-(4-fluor;
cipram;
N,N-dimethylamino-3-chloropropane HCL;
1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3;
5-Isobenzofurancarbonitrile, 1-3-(dimethylamino)propyl-1-(4-fluorophenyl)-1,3-dihydro-;
CITALOPRAM(SUBJECTTOPATENTFREE);
1-(3-dimethylaminopropyl)-1-(4-fluorophenyl)-3H-isobenzofuran-5-carbonitrile;
citalopram;
Benzamide, 4-amino-N-(2-aminophenyl)-;
Dinalin;
Isepamicin;
Pigment Blue 29;
Ethyl p-(6-guanidinohexanoyloxy) benzoate methanesulfonate;
4-((6-((aminoiminomethyl)amino)-1-oxohexyl)oxyl)benzoic acid ethyl ester mesylate salt;
gabexate mesylate
英文别名：
vindesine sulfate;
Vindesine Sulfate Salt;
Vindesine sulphate
精确分子量/精确质量：
851.37800
极性分子表面积/PSA：
247.80000
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：
261-984-7
InChI：
InChI=1/C43H55N5O7.H2O4S/c1-6-39(52)21-25-22-42(38(51)55-5,33-27(13-17-47(23-25)24-39)26-11-8-9-12-30(26)45-33)29-19-28-31(20-32(29)54-4)46(3)35-41(28)15-18-48-16-10-14-40(7-2,34(41)48)36(49)43(35,53)37(44)50;1-5(2,3)4/h8-12,14,19-20,25,34-36,45,49,52-53H

生产制备方法及用途展开↓

制备方法

方法1:同样以长春碱为原料,在常压下和无水肼反应生成肼化物,经二氯甲烷萃取后得干燥品。溶于THF,加入盐酸,在0℃滴加亚硝酸丁酯,生成叠氮化合物,再加入三苯基膦的THF溶液。去除杂质后,用氨水中和,然后用二氯甲烷萃取,真空蒸干,用柱层析或高压液相分离即得长春地辛。方法2:长春碱在无水甲醇溶液中,加入无水液氨,于100℃和加压下。进行约60h的氨解水解。反应完毕后,真空蒸发至干,柱层析分离得到长春地辛。方法3:同样以长春碱为原料,在常压下,和无水肼反应后再还原得到长春地辛。

用途简介

抗癌药。

物化性质展开↓

外观与性状：
非晶形的固体
密度：
1.41 g/cm3
熔点：
>250ºC

安全信息展开↓

包装等级：
II
风险类别：
6.1(a)
海关代码：
2942000000
危险类别码：
R40
安全说明：
26-36
危险标志：
Xn: Harmful;

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YY8090000
CAS REGISTRY NUMBER :
59917-39-4
LAST UPDATED :
199706
DATA ITEMS CITED :
11
MOLECULAR FORMULA :
C43-H55-N5-O7.H2-O4-S
MOLECULAR WEIGHT :
852.11

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1050 ug/kg
TOXIC EFFECTS :
Behavioral - ataxia Gastrointestinal - hypermotility, diarrhea Kidney, Ureter, Bladder - urine volume increased
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1790 ug/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 - rat
DOSE/DURATION :
1920 ug/kg
TOXIC EFFECTS :
Gastrointestinal - hypermotility, diarrhea Kidney, Ureter, Bladder - urine volume increased Blood - normocytic anemia
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
3500 ug/kg
TOXIC EFFECTS :
Behavioral - ataxia Gastrointestinal - hypermotility, diarrhea Kidney, Ureter, Bladder - urine volume increased
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
6800 ug/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 :
6300 ug/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 :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1250 ug/kg/33D-I
TOXIC EFFECTS :
Endocrine - other changes Blood - changes in bone marrow (not otherwise specified) Biochemical - Enzyme inhibition, induction, or change in blood or tissue levels - transaminases
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intravenous
DOSE :
1250 ug/kg
SEX/DURATION :
male 10 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Paternal Effects - testes, epididymis, sperm duct Reproductive - Paternal Effects - prostate, seminal vesicle, Cowper's gland, accessory glands
TYPE OF TEST :
Micronucleus test

MUTATION DATA

TYPE OF TEST :
Mutation test systems - not otherwise specified
TEST SYSTEM :
Rodent - hamster Ovary
DOSE/DURATION :
28 nmol/L
REFERENCE :
CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 38,2886,1978
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