利胆丁酸

利胆丁酸 基本信息
CAS号 30544-61-7 分子式 C18H18ClNO4
分子量 347.79300 精确质量  347.09200
PSA  66.84000 LogP  3.86020

基本信息 展开↓

CAS号:
30544-61-7
3D弹球模型:
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分子式:
C18H18ClNO4
分子量:
347.79300
中文名称:
利胆丁酸
英文名称:
4-(N-(4-chlorobenzoyl)-4-methoxyanilino)butanoic acid
中文别名:
利胆丁酸;
2-[[3-(Trifluoromethyl)phenyl]amino]benzoic Acid 2-(2-Hydroxyethoxy)ethyl Ester;
30544-47-9;
N-(a,a,a-Trifluoro-m-tolyl)anthranilic Acid 2-(2-Hydroxyethoxy)ethyl Ester;
Etofenamate;
1-(3-azido-2,3-dideoxy-beta-D-threo-pentofuranosyl)-5-methylpyrimidine-2,4(1H,3H)-dione;
1-[(3xi)-3-azido-2,3-dideoxy-beta-D-glycero-pentofuranosyl]-5-methylpyrimidine-2,4(1H,3H)-dione;
1-(3-Azido-2,3-Dideoxy-Beta-D-Ribofuranosyl)Thymine;
3'-Azido-3'-thymidine;
Zidovudine(AZT);
Zidovudine;
2,2'-(E)-ethene-1,2-diyldianiline;
(1S,2S)-1,2-diphenylethane-1,2-diaminium;
(1S,2S)-(?)-1,2-Diphenylethylenediamine;
1,2-Ethanediamine, 1,2-diphenyl-,(1S,2S)-;
(1S,2S)-(−
)-1,2-Diphenylethylenediamine;
(1S,2S)-1,2-Diphenyl-1,2-ethanediamine;
S-2-Chlorpropionic acid;
2-chloro-2-methylpropanoic acid;
(S)-a-chloropropionic acid;
(S)-2-Chloropropanoic Acid;
S-(-)-2-Chloropropionic Acid;
N-Aminomethyldopa;
NCGC00024596-01;
S(-)-CARBIDOPA;
SMR000058235;
Tocris-0455;
(2S);
S-(-)-carbidopa
英文别名:
4-(N-(4-chlorobenzoyl)-4-methoxyanilino)butanoic acid;
Clanobutine;
Clanobutine [INN-French];
Clanobutin;
EINECS 250-232-3;
Clanobutina [INN-Spanish];
Clanobutin [INN];
N-(p-chlorobenzoyl)-4-(p-anisidino)-butyric acid;
Bykahepar;
4-<4-chloro-N-(4-methoxyphenyl)-benzamido>-butyric acid;
4-butyric acid;
Clanobutinum [INN-Latin]
精确分子量/精确质量:
347.09200
极性分子表面积/PSA:
66.84000
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:
250-232-3
InChI:
InChI=1/C18H18ClNO4/c1-24-16-10-8-15(9-11-16)20(12-2-3-17(21)22)18(23)13-4-6-14(19)7-5-13/h4-11H,2-3,12H2,1H3,(H,21,22)

物化性质展开↓

密度:
1.302g/cm3
沸点:
562.4ºC at 760mmHg
闪点:
294ºC
折射率:
1.61

安全信息展开↓

海关代码:
2924299090

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
ES8352000
CHEMICAL NAME :
Butyric acid, 4-(p-chloro-N-(p-methoxyphenyl)benzamido)-
CAS REGISTRY NUMBER :
30544-61-7
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C18-H18-Cl-N-O4
MOLECULAR WEIGHT :
347.82

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 :
>2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #3780095
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
570 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
GWXXBX German Offenlegungsschrift Patent Document. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #1917036

海关数据查看详细

中国海关编码:2924299090

概述:
2924299090. 其他环酰胺(包括环氨基甲酸酯)(包括其衍生物以及他们的盐). 增值税率:17.0%. 退税率:13.0%. 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, 包装
摘要/Summary:
2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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