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About This Item
线性分子式:
CH3CO2C6H4CO2H
CAS Number:
分子量:
180.16
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22
方案
98%
mp
131-134 °C (lit.)
官能团
carboxylic acid
ester
SMILES字符串
CC(=O)Oc1cccc(c1)C(O)=O
InChI
1S/C9H8O4/c1-6(10)13-8-4-2-3-7(5-8)9(11)12/h2-5H,1H3,(H,11,12)
InChI key
NGMYCWFGNSXLMP-UHFFFAOYSA-N
一般描述
3-Acetoxybenzoic acid (3-ABA), a meta-substituted benzoic acid, is an isomer of aspirin. It can be synthesized by reacting 3-hydroxybenzoic acid with acetic anhydride. The esterification of 3-ABA with 1,1′-carbonyldiimidazole (CDI) in the presence of reactive halides has been reported.
应用
3-Acetoxybenzoic acid (3-aBH) may be used as a ligand to prepare:
- bis-(3-acetoxybenzoato)triphenylantimony(V)
- bis-(3-acetoxybenzoato)triphenylbismuth(V)
- [Ln(3-ab)3(N2H4)2]·xH2O (Ln = La,Ce, Pr, Nd, Sm and Gd; N2H4= hydrazine)
警示用语：
Warning
危险声明
危险分类
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
靶器官
Respiratory system
储存分类代码
11 - Combustible Solids
WGK
WGK 3
闪点(°F)
Not applicable
闪点(°C)
Not applicable
个人防护装备
dust mask type N95 (US), Eyeshields, Gloves
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