3-氨基-4-氯苯磺酸 | 98-36-2
中文名称:
3-氨基-4-氯苯磺酸
英文名称:
3-Amino-4-chlorobenzenesulfonic acid
CAS No.:
98-36-2
分子式:
C6 H6 ClNO3 S
分子量:
207.6347
名称和标识符
MDL
MFCD00035764
InChIKey
XJQRCFRVWZHIPN-UHFFFAOYSA-N
Inchi
1S/C6H6ClNO3S/c7-5-2-1-4(3-6(5)8)12(9,10)11/h1-3H,8H2,(H,9,10,11)
SMILES
ClC1C([H])=C([H])C(=C([H])C=1N([H])[H])S(=O)(=O)O[H]
别名信息
- 中文别名 -
3-氨基-4-氯苯磺酸
2-氯苯胺-5-磺酸
2-Chloroaniline-5-sulfonic Acid 2-氯苯胺-5-磺酸
2-氨基氯苯-4-磺酸
对氯间氨基苯磺酸
- 英文别名 -
2-Chloroaniline-5-sulfonic acid
4-Chlorometanilic acid
1-CHLORO-2-AMINOBENZENE-4-SULFONIC ACID
3-AMINO-4-CHLORO-BENZENESULFONIC ACID
3-AMINO-4-CHLOROBENZENESULFONIC ACID HYDRATE
3-Amino-4-choloro-benzenesulfonic acid(2-CHLOROANILINE-5-SULFONIC ACID)
3-AMINO-4-CHOLORO-BENZENESULFONICACID
6-CHLOROANILINE-3-SULFONIC ACID
6-CHLOROMETANILIC ACID
3-Amino-4-chlorobenzenesulfonic Acid
Benzenesulfonic acid, 3-amino-4-chloro-
3-Amino-4-chlorobenzenesulphonic acid
Metanilic acid, 4-chloro-
XJQRCFRVWZHIPN-UHFFFAOYSA-N
3-amino-4-chlorobenzene-1-sulfonic acid
o-Chloroaniline m-sulfonic acid
2-Chloroaniline-5-sulfonicAcid
NSC7538
NSC 59702
NSC59702
FT-0611658
SB77446
AC-11815
AKOS003193910
SCHEMBL341943
W-100083
3-amino-4-chlorobenzenesulfonicacid
DTXSID4059170
BENZENESULPHONIC ACID, 3-AMINO-4-CHLORO-
MFCD00035764
EINECS 202-661-2
FT-0607596
UNII-4MB9E88J9W
3-Amino-4-chloro-benzenesulfonic acid
4MB9E88J9W
3-Amino-4-chlorobenzenesulfonic acid
D88512
AS-64111
NS00040533
ammonia
benzene
hydrogen sulfite
hydrochloride
NSC-7538
98-36-2
A845849
CS-0206125
1-amino-6-chlorobenzene-3-sulphonic acid
NSC-59702
物化性质
实验特性
LogP
2.83090
PSA
88.77000
沸点
500
熔点
300 ºC
颜色与性状
粉红-米色-浅棕色结晶状粉末
溶解性
未确定
密度
1.642
计算特性
精确分子量
206.97600
氢键供体数量
2
氢键受体数量
4
可旋转化学键数量
1
同位素质量
206.975691
重原子数量
12
复杂度
248
同位素原子数量
0
确定原子立构中心数量
0
不确定原子立构中心数量
0
确定化学键立构中心数量
0
不确定化学键立构中心数量
0
共价键单元数量
1
疏水参数计算参考值(XlogP)
1
互变异构体数量
无
表面电荷
0
拓扑分子极性表面积
88.8
海关数据
海关编码
2921420090
海关数据
中国海关编码:
2921420090
概述:
2921420090 其他苯胺衍生物及其盐. 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
Summary:
HS:2921420090 aniline derivatives and their salts VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%
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参考资料
Reaxys RN
2693041
Beilstein
14(2)435
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