分子结构:
CCD编号:CCD00002445
3,4-二甲基苯甲酸
CAS号:
619-04-5
分子式:C9H10O2
分子量:150.176
* If the product has intellectual property rights, a license granted is must or contact us.
|
|
| 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： | 3,4-DIMETHYLBENZOIC ACID ; O-XYLYLIC ACID ; O-XYLENE-4-CARBOXYLIC ACID ; ZERENEX ZX-IP007365 ; LABOTEST-BB LT01148418 ; PARAGOS 440018 ; LABOTEST-BB LT03333428 ; RARECHEM AL BO 0330 ; BENZOIC ACID, 3,4-DIMETHYL- ; ZERENEX ZX-AB001655 ; ASYM-O-XYLYLIC ACID |
| 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 |
|
|
| 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 |
|
|
| WGK德国： | 3 |
基本信息
* If the product has intellectual property rights, a license granted is must or contact us.
