basic_info |
|
| Product_Name： | 尿黑酸 |
| CAS： | 451-13-8 |
| 中文同义词： | 升龙胆酸 ; 尿黑酸 ; 高龙胆酸 ; 2,5-二羥苯乙酸 ; 2,5-二羟基苯乙酸 |
| EnglishSynonyms： | 1,4-HYDROQUINONEACETIC ACID ; 2,5-DIHYDROXY-ALPHA-TOLUIC ACID ; 2-(2,5-DIHYDROXYPHENYL)ACETIC ACID ; 2,5-DIHYDROXYPHENYLACETIC ACID ; DIHYDROXYPHENYLACETIC ACID,2,5- ; HOMOGENTISIC ACID |
| pro_mdlNumber： | MFCD00004324 |
| pro_acceptors： | 4 |
| pro_donors： | 3 |
| pro_smile： | c1cc(c(cc1O)CC(=O)O)O |
| InChi： | InChI=1S/C8H8O4/c9-6-1-2-7(10)5(3-6)4-8(11)12/h1-3,9-10H,4H2,(H,11,12) |
| InChiKey： | InChIKey=IGMNYECMUMZDDF-UHFFFAOYSA-N |
property |
|
| MeltingPoint： | 150-152 DEG C(LIT) |
| Comments： | COLOR: OFF-WHITE TO TAN FORM: CRYSTALLINE OTHER NOTES: TANDEM MASS SPECTROMETRY DATA INDEPENDENTLY GENERATED BY SCRIPPS CENTER FOR METABOLOMICS IS AVAILABLE TO VIEW OR DOWNLOAD IN PDF. H0751.PDF TESTED METABOLITES ARE FEATURED ON SCRIPPS CENTER FOR METABOLOMICS METLIN METABOLITE DATABASE. TO LEARN MORE, VISIT SIGMA.COM/METLIN RTECS: AH0589000 STORAGE TEMPERATURE: 2-8 DEG C UNSPSC: 12352100 WGK: 3 |
secure_info |
|
| secure_symbol： |
GHS07
|
| secure_signal_word： | Warning |
| secure_risk_stmt： | H315-H319-H335 |
| secure_cautionary_stmt： | P261-P305 + P351 + P338 |
| secure_damage_code： | Xi |
| secure_risk_disclosure_stmt： | R:36/37/38 |
| secure_security_stmt： | S:26-36 |
| secure_wgk_germany： | 3 |
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