环苯扎林

环苯扎林 基本信息
CAS号 303-53-7 分子式 C20H21N
分子量 275.38700 精确质量  275.16700
PSA  3.24000 LogP  4.55380

基本信息 展开↓

CAS号:
303-53-7
3D弹球模型:
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分子式:
C20H21N
分子量:
275.38700
中文名称:
环苯扎林
英文名称:
cyclobenzaprine
中文别名:
环苯扎林;
甲普罗替林;
去氢替林;
3-chloro-10,11-dihydro-N,N-dimethyl-5H-Dibenz(b,f)azepine-5-propanamine;
3-Chloro-10,11-dihydro-N,N-dimethyl-5H-dibenz[b,f]azepine-5-propanamine;
3-Chloro-5-[3-(dimethylamino)propyl]-10,11-dihydro-5H-dibenz[b,f]azepine;
5-(g-Dimethylaminopropyl)-3-chloroiminodibenzyl;
5H-Dibenz(b,f)azepine-5-propanamine, 3-chloro-10,11-dihydro-N,N-dimethyl-;
5H-Dibenz[b,f]azepine-5-propanamine, 3-chloro-10,11-dihydro-N,N-dimethyl-;
3-(3-chloro-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-N,N-dimethylpropan-1-amine;
Chlorimipramine;
Clomipramine;
1-methyl-3-oxoandrost-1-en-17-yl heptanoate;
(5alpha,17beta)-1-methyl-3-oxoandrost-1-en-17-yl heptanoate;
MethenoloneEnanthane;
Methenolone Enanthate;
PYROCATECHOL-3-CARBOXYLIC ACID;
O-PYROCATECHUIC ACID;
TIMTEC-BB SBB008367;
RARECHEM AL BE 0035;
2,3-Dihydroxybenzoic acid;
Sodium 3-alpha,12-alpha-dihydroxy-5-beta-cholan-24-oate;
sodium (3alpha,5beta,12alpha)-3,12-dihydroxycholan-24-oate;
cholan-24-oic acid, 3-hydroxy-, monosodium salt, (3alpha,5beta)-;
oxoniomethyl;
sodium 3-α,12-α-dihydroxy-5
英文别名:
cyclobenzaprine;
Cyclobenz;
Yurelax;
Flexeril;
Proeptatriene;
Cyclobenzaprinum;
3-(dibenzo[1,2-a:1',2'-e][7]annulen-11-ylidene)-N,N-dimethylpropan-1-amine;
Proheptatrien;
Proheptatriene;
Ciclobenzaprina;
Lisseril
精确分子量/精确质量:
275.16700
极性分子表面积/PSA:
3.24000
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:
206-145-8
InChI:
InChI=1/C20H21N.ClH/c1-21(2)13-7-11-19-15-17-9-4-3-8-16(17)14-18-10-5-6-12-20(18)19;/h3-6,8-12,14-15H,7,13H2,1-2H3;1H/b19-11-;

物化性质展开↓

外观与性状:
固体
密度:
1.096 g/cm3
沸点:
405.9ºC at 760 mmHg
闪点:
177.8ºC

安全信息展开↓

海关代码:
2921499090

合成路线查看所有的合成路线

  • 6682-26-4

    环苯扎林N-氧化物

  • ~93%

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    环苯扎林

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    环苯扎林

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
HP0550000
CHEMICAL NAME :
5H-Dibenzo(a,d)cycloheptene-delta(sup 5),gamma-propylamine, N,N-dimethyl-
CAS REGISTRY NUMBER :
303-53-7
LAST UPDATED :
199803
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C20-H21-N
MOLECULAR WEIGHT :
275.42
WISWESSER LINE NOTATION :
L C676 BY&T&J BU3N1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
250 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRPPAO Farmaco, Edizione Pratica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 25,519,1970
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
90 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 6,338,1963
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
36 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRPPAO Farmaco, Edizione Pratica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 25,519,1970

海关数据查看详细

中国海关编码:2921499090

概述:
2921499090 其他芳香单胺及衍生物及它们的盐. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:6.5% 普通关税:30.0%
申报要素:
品名, 成分含量, 用途
摘要/Summary:
2921499090 other aromatic monoamines and their derivatives; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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