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About This Item
线性分子式:
ClCH2C6H4CO2H
CAS号:
分子量:
170.59
Beilstein:
637114
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22
质量水平
检测方案
97%
mp
136-138 °C (lit.)
溶解性
methanol: soluble 20 mg/mL, clear
SMILES字符串
OC(=O)c1cccc(CCl)c1
InChI
1S/C8H7ClO2/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4H,5H2,(H,10,11)
InChI key
PBSUMBYSVFTMNG-UHFFFAOYSA-N
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一般描述
3-(Chloromethyl)benzoic acid (m-Chloromethylbenzoic acid) is a meta-substituted benzoic acid derivative. Correlations between Hammett substituent constants and calculated dipole moments and molecular transform and normalized molecular moment structure indices for m-chloromethylbenzoic acid was investigated. Hammett constants were observed to be linearly related only to the normalized charge moment index.
警示用语：
Danger
危险分类
Acute Tox. 4 Oral - Skin Corr. 1B
WGK
WGK 3
闪点(°F)
Not applicable
闪点(°C)
Not applicable
个人防护装备
Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
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