3,4-二甲基苯甲酸

CAS号
619-04-5
CCD编号
CCD00002445
分子式
C9H10O2
分子量
150.176

基本信息

产品名称: 3,4-二甲基苯甲酸
CAS: 619-04-5
中文同义词: 3,4-二甲基苯甲酸
英文同义词: BENZOIC ACID, 3,4-DIMETHYL- ; ZERENEX ZX-IP007365 ; ASYM-O-XYLYLIC ACID ; ZERENEX ZX-AB001655 ; RARECHEM AL BO 0330 ; LABOTEST-BB LT03333428 ; PARAGOS 440018 ; O-XYLENE-4-CARBOXYLIC ACID ; O-XYLYLIC ACID ; 3,4-DIMETHYLBENZOIC ACID ; LABOTEST-BB LT01148418
MDL号: MFCD00002524
氢键受体数量: 2
氢键供体数量: 1
Smile: CC=1C=C(C(=O)O)C=CC1C
InChi: InChI=1S/C9H10O2/c1-6-3-4-8(9(10)11)5-7(6)2/h3-5H,1-2H3,(H,10,11)
InChiKey: InChIKey=OPVAJFQBSDUNQA-UHFFFAOYSA-N

性质

熔点: 163-165 DEG C(LIT)
注解: OTHER NOTES: TANDEM MASS SPECTROMETRY DATA INDEPENDENTLY GENERATED BY SCRIPPS CENTER FOR METABOLOMICS IS AVAILABLE TO VIEW OR DOWNLOAD IN PDF. D149403.PDF TESTED METABOLITES ARE FEATURED ON SCRIPPS CENTER FOR METABOLOMICS METLIN METABOLITE DATABASE. TO LEARN MORE, VISIT SIGMA.COM/METLIN
RTECS: DG8734020
UNSPSC: 12352100
WGK: 3

安全信息

WGK德国: 3

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