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化合物简介
扁桃酸(化学式:C8H8O3),又名苦杏仁酸、苯乙醇酸,学名α-羟基苯乙酸。
基本信息
CAS:17199-29-0
中文别名:扁桃酸;(S)-扁桃酸;L-扁桃酸;S-(+)-扁桃酸;(S)-α-羟基苯乙酸;S-扁桃酸;L-(+)-扁桃酸;
英文别名:(S)-(+)-2-hydroxy-2-phenylacetic acid;(S)-2-Hydroxy-2-phenylacetic acid;L-mandelate;(S)-(+)-Mandelic Acid;L-(+)-Mandelic Acid;(S)-(+)-Amygdalic Acid;hydroxyphenylacetic acid;(S)-α-Hydroxyphenylacetic acid;Benzeneacetic acid, α-hydroxy-, (S)-;phenyl-hydroxy-acetic acid;2-phenyl-2-hydroxyethanoic acid;(S)-(+)-Mandelic acid;
分子式:C8H8O3
分子量:152.147
精确质量:152.047
Psa:57.53
Logp:0.8046
中文别名:扁桃酸;(S)-扁桃酸;L-扁桃酸;S-(+)-扁桃酸;(S)-α-羟基苯乙酸;S-扁桃酸;L-(+)-扁桃酸;
英文别名:(S)-(+)-2-hydroxy-2-phenylacetic acid;(S)-2-Hydroxy-2-phenylacetic acid;L-mandelate;(S)-(+)-Mandelic Acid;L-(+)-Mandelic Acid;(S)-(+)-Amygdalic Acid;hydroxyphenylacetic acid;(S)-α-Hydroxyphenylacetic acid;Benzeneacetic acid, α-hydroxy-, (S)-;phenyl-hydroxy-acetic acid;2-phenyl-2-hydroxyethanoic acid;(S)-(+)-Mandelic acid;
分子式:C8H8O3
分子量:152.147
精确质量:152.047
Psa:57.53
Logp:0.8046
编号系统
MDL号:MFCD00004495
PubChem号:24896592
BRN号:2208678
EINECS号:241-240-8
PubChem号:24896592
BRN号:2208678
EINECS号:241-240-8
物化性质
外观与性状:白色晶体
密度:1.321g/cm3
沸点:321.8ºC at 760mmHg
熔点:131-134°C(lit.)
闪点:162.6ºC
折射率:153.5 ° (C=1, H2O)
水溶解性:100 g/L (25 ºC)
稳定性:Stable, but light sensitive. Combustible. Incompatible with strong bases, strong oxidizing agents, strong reducing agents.
储存条件:Store in a cool, dry place. Do not store in direct sunlight. Store in a tightly closed container.
蒸汽压:0.00012mmHg at 25°C
密度:1.321g/cm3
沸点:321.8ºC at 760mmHg
熔点:131-134°C(lit.)
闪点:162.6ºC
折射率:153.5 ° (C=1, H2O)
水溶解性:100 g/L (25 ºC)
稳定性:Stable, but light sensitive. Combustible. Incompatible with strong bases, strong oxidizing agents, strong reducing agents.
储存条件:Store in a cool, dry place. Do not store in direct sunlight. Store in a tightly closed container.
蒸汽压:0.00012mmHg at 25°C
安全信息
安全说明:S22-S24/25-S37/39-S26
WGK Germany:3
危险类别码:R36/37/38
海关编码:2918199090
危险品标志:Xi
WGK Germany:3
危险类别码:R36/37/38
海关编码:2918199090
危险品标志:Xi
生产方法及用途
用途
医药原料药,拆分胺类化合物。
医药原料药,拆分胺类化合物。
合成路线
上游原料
下游产品
图谱
Predict 1H proton NMR

13C NMR : Predict

1H NMR : Predict

Mass spectrum (electron ionization)
