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化合物简介
Benzoic acid derivative used in the preparation of antiinflammatory and antirheumatic agents. A potential geothermal tracer.
基本信息
CAS:632-46-2
中文别名:2,6-甲基苯甲酸;
英文别名:Benzoic acid, 2,6-dimethyl-;2,5-DIMETHYL FURAN;2,6-DiMethybenzoic acid;VIC-M-XYLYLIC ACID;2,6-dimethyl-benzoicaci;2,6-dimethylbenzene carboxylic acid;2,6-Dimethylbenzoic acid;Benzoic acid,2,6-dimethyl;M-XYLENE-2-CARBOXYLIC ACID;2,6-Me2C6H3CO2H;2,6-Dimethylbenzoicacid;RARECHEM AL BO 0401;
分子式:C9H10O2
分子量:150.174
精确质量:150.068
Psa:37.3
Logp:2.0016
中文别名:2,6-甲基苯甲酸;
英文别名:Benzoic acid, 2,6-dimethyl-;2,5-DIMETHYL FURAN;2,6-DiMethybenzoic acid;VIC-M-XYLYLIC ACID;2,6-dimethyl-benzoicaci;2,6-dimethylbenzene carboxylic acid;2,6-Dimethylbenzoic acid;Benzoic acid,2,6-dimethyl;M-XYLENE-2-CARBOXYLIC ACID;2,6-Me2C6H3CO2H;2,6-Dimethylbenzoicacid;RARECHEM AL BO 0401;
分子式:C9H10O2
分子量:150.174
精确质量:150.068
Psa:37.3
Logp:2.0016
编号系统
EINECS号:211-177-0
MDL号:MFCD00002483
MDL号:MFCD00002483
物化性质
外观与性状:白色至淡奶油色结晶粉末
密度:1.116 g/cm3
沸点:160 °C / 17mmHg
熔点:114-116°C(lit.)
闪点:126.1ºC
折射率:1.55
稳定性:Stable under normal temperatures and pressures.
储存条件:Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
密度:1.116 g/cm3
沸点:160 °C / 17mmHg
熔点:114-116°C(lit.)
闪点:126.1ºC
折射率:1.55
稳定性:Stable under normal temperatures and pressures.
储存条件:Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
安全信息
RTECS号:DG8734010
安全说明:S26-S36-S24/25
危险类别码:R36/37/38
WGK Germany:3
海关编码:29163900
危险品标志:Xi
安全说明:S26-S36-S24/25
危险类别码:R36/37/38
WGK Germany:3
海关编码:29163900
危险品标志:Xi
生产方法及用途
合成路线
上游原料
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图谱
Predict 1H proton NMR

13C NMR : Predict

1H NMR : Predict

13C NMR : in CDCl3

1H NMR : 90 MHz in CDCl3

Mass spectrum (electron ionization)

Mass

IR : KBr disc

IR : nujol mull
