2-丙基-5-噻唑羧酸

2-丙基-5-噻唑羧酸 基本信息
CAS号 30709-69-4 分子式 C7H9NO2S
分子量 171.21700 精确质量  171.03500
PSA  78.43000 LogP  1.79380

基本信息 展开↓

CAS号:
30709-69-4
3D弹球模型:
立即前往扯扯看
分子式:
C7H9NO2S
分子量:
171.21700
中文名称:
2-丙基-5-噻唑羧酸
英文名称:
2-propyl-1,3-thiazole-5-carboxylic acid
中文别名:
2-丙基-5-噻唑羧酸;
噻唑普罗酸
英文别名:
2-propyl-1,3-thiazole-5-carboxylic acid;
2-n-Propyl-5-thiazolcarbonsaeure;
2-n-propyl-5-carboxythiazol;
Acido tizoprolico [INN-Spanish];
Acide tizoprolique [INN-French];
Acidum tizoprolicum [INN-Latin];
Tizoprolic acid;
Acide tizoprolique;
2-Propylthiazole-5-carboxylic acid;
2-propyl-5-thiazolecarboxylic acid;
2-Propyl-thiazol-5-carbonsaeure;
2-Propyl-5-thiazolcarbonsaeure;
5-Thiazolecarboxylic acid,2-propyl
精确分子量/精确质量:
171.03500
极性分子表面积/PSA:
78.43000
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。
InChI:
InChI=1/C7H9NO2S/c1-2-3-6-8-4-5(11-6)7(9)10/h4H,2-3H2,1H3,(H,9,10)

物化性质展开↓

密度:
1.277g/cm3
沸点:
314.5ºC at 760 mmHg
闪点:
144ºC
折射率:
1.568

安全信息展开↓

海关代码:
2934100090

合成路线查看所有的合成路线

  • 50680-74-5

    5-​Thiazolecarboxylic acid, 2-​propyl-​, ethyl ester

  • 30709-69-4

    2-丙基-5-噻唑羧酸

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XJ3716666
CHEMICAL NAME :
5-Thiazolecarboxylic acid, 2-propyl-
CAS REGISTRY NUMBER :
30709-69-4
LAST UPDATED :
199806
DATA ITEMS CITED :
2

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 :
>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: #4045567
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1680 mg/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: #4045567

海关数据查看详细

中国海关编码:2934100090

概述:
2934100090. 结构上含有一个非稠合噻唑环的化合物(不论是否氢化). 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:20.0%
申报要素:
品名, 成分含量, 用途
摘要/Summary:
2934100090 other compounds containing an unfused thiazole ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%

上下游相关产品

上游产品

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  • 50680-74-5

    5-​Thiazolecarboxylic acid, 2-​propyl-​, ethyl ester

下游产品

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  • 50930-37-5

    N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2-propyl-1,3-thiazole-5-carboxamide

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