3-氯-4-甲硫基苯乙酸

3-氯-4-甲硫基苯乙酸 基本信息
CAS号 87776-75-8 分子式 C9H9ClO2S
分子量 216.68500 精确质量  216.00100
PSA  62.60000 LogP  2.68900

基本信息 展开↓

CAS号:
87776-75-8
3D弹球模型:
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分子式:
C9H9ClO2S
分子量:
216.68500
中文名称:
3-氯-4-甲硫基苯乙酸
英文名称:
2-(3-chloro-4-methylsulfanylphenyl)acetic acid
中文别名:
3-氯-4-甲硫基苯乙酸;
N,N'-bis(2,3-dihydroxypropyl)-5-[(hydroxyacetyl)(2-hydroxyethyl)amino]-2,4,6-triiodobenzene-1,3-dicarboxamide;
1,3-Benzenedicarboxamide, N,N'-bis(2,3-dihydroxypropyl)-5-[(hydroxyacetyl)(2-hydroxyethyl)amino]-2,4,6-triiodo-, [R-(R*,R*)]-;
1,3-Benzenedicarboxamide, N,N'-bis(2,3-dihydroxypropyl)-5-[(hydroxyacetyl)(2-hydroxyethyl)amino]-2,4,6-triiodo-, (R*,S*)-;
Ioversol;
tandospirone;
1-Butanaminium, N,N,N-tributyl-, fluoride, trihydrate;
Tetrabutylammoniumfluoridetrihydrate;
Tetra Butyl Ammonium Fluoride Trihydrate;
TBAF 3H2O;
(2S)-tetrahydrofuran-2-carboxylate;
(R)-tetrahydrofuran-2-carboxylic acid;
emadine;
1-(2-ethoxyethyl)-2-(4-methyl-1,4-diazepan-1-yl)-1H-benzimidazole di[(2E)-but-2-enedioate];
Emedastine Difumarate;
BOC-PIP(4-NH2);
tert-butyl 4-aminopiperidine-1-carboxylate;
4-Amino-N-Boc-piperidine;
1-(tert-butoxycarbonyl)piperidin-4-aminium;
N-tert-Butoxycarbonyl-4-aminopiperidine;
N-Boc-4-Amino Piperidine;
N-Boc-4-amino-piperidine;
1-Boc-aminopiperidine;
N-Boc-4-piperidineamine
英文别名:
2-(3-chloro-4-methylsulfanylphenyl)acetic acid;
[3-Chloro-4-(methylsulfanyl)phenyl]acetic acid;
benzeneacetic acid, 3-chloro-4-(methylthio)-;
3-Chloro-4-(methylthio)phenylacetic acid;
1,3-Benzenedicarboxamide, N,N'-bis(2,3-dihydroxypropyl)-5-[(hydroxyacetyl)(2-hydroxyethyl)amino]-2,4,6-triiodo-, (R*,S*)-;
Ioversol;
tandospirone;
1-Butanaminium, N,N,N-tributyl-, fluoride, trihydrate;
Tetrabutylammoniumfluoridetrihydrate;
Tetra Butyl Ammonium Fluoride Trihydrate;
TBAF 3H2O;
(2S)-tetrahydrofuran-2-carboxylate;
(R)-tetrahydrofuran-2-carboxylic acid;
emadine;
1-(2-ethoxyethyl)-2-(4-methyl-1,4-diazepan-1-yl)-1H-benzimidazole di[(2E)-but-2-enedioate];
Emedastine Difumarate;
BOC-PIP(4-NH2);
tert-butyl 4-aminopiperidine-1-carboxylate;
4-Amino-N-Boc-piperidine;
1-(tert-butoxycarbonyl)piperidin-4-aminium;
N-tert-Butoxycarbonyl-4-aminopiperidine;
N-Boc-4-Amino Piperidine;
N-Boc-4-amino-piperidine;
1-Boc-aminopiperidine;
N-Boc-4-piperidineamine
精确分子量/精确质量:
216.00100
极性分子表面积/PSA:
62.60000
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/C9H9ClO2S/c1-13-8-3-2-6(4-7(8)10)5-9(11)12/h2-4H,5H2,1H3,(H,11,12)

物化性质展开↓

密度:
1.364g/cm3
沸点:
351.233ºC at 760 mmHg
闪点:
166.22ºC
折射率:
1.611

安全信息展开↓

海关代码:
2930909090

合成路线查看所有的合成路线

  • 300355-11-7

    300355-11-7

  • 87776-75-8

    3-氯-4-甲硫基苯乙酸

  • 393165-02-1

    (3-chloro-4-methylsulfanyl-phenyl)-oxo-acetic acid methyl ester

  • 87776-75-8

    3-氯-4-甲硫基苯乙酸

  • 17733-22-1

    2-氯茴香硫醚

  • 87776-75-8

    3-氯-4-甲硫基苯乙酸

海关数据查看详细

中国海关编码:2930909090

概述:
2930909090. 其他有机硫化合物. 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
摘要/Summary:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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