α-环己基-DL-扁桃酸

pro_cas
4335-77-7 ;50896-04-3
pro_cdbregno
CCD00092328
pro_formula
C14 H18 O3
pro_molWeight
234.293

basic_info

Product_Name: α-环己基-DL-扁桃酸
CAS: 4335-77-7 ;50896-04-3
中文同义词: -环己基-DL-扁桃酸 ; 2-环己基-2-羟基苯乙酸 ; 2-环己基-2-羟基-2-苯乙酸 ; 环己基扁桃酸 ; α-环己基扁桃酸 ; 2'-环己基扁桃酸 ; α-环己基-DL-扁桃酸
EnglishSynonyms: CYCLOHEXYL-HYDROXY-PHENYL-ACETIC ACID ; 2-CYCLOHEXYL-2-HYDROXY-PHENYLACETIC ACID,WHITE SOLID ; 2-CYCLOHEXYL-2-HYDROXY-PHENYLACETIC ACID ; 2-CYCLOHEXYL-2-HYDROXY-2-PHENYLACETIC ACID ; CYCLOHEXYLPHENYLGLYCOLIC ACID ; ALPHA-CYCLOHEXYL-DL-MANDELIC ACID ; A-CYCLOHEXYL-A-HYDROXYPHENYL ACETIC ACID ; CYCLOHEXYLMANDELIC ACID, 98% ; 2-CYCLOHEXYLMANDELIC ACID ; A-CYCLOHEXYLMANDELIC ACID ; ALPHA-CYCLOHEXYLMANDELIC ACID ; 2-CYCLOHEXYL-2-PHENYLGLYCOLIC ACID ; CYCLOHEXYLMANDELIC ACID ; ALPHA-CYCLOHEXYL-ALPHA-HYDROXYPHENYL ACETIC ACID
pro_mdlNumber: MFCD00194543
pro_acceptors: 3
pro_donors: 2
pro_smile: c1ccc(cc1)C(C2CCCCC2)(C(=O)O)O
InChi: InChI=1S/C14H18O3/c15-13(16)14(17,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1,3-4,7-8,12,17H,2,5-6,9-10H2,(H,15,16)
InChiKey: InChIKey=YTRNSQPXEDGWMR-UHFFFAOYSA-N

property

MeltingPoint: 170-175 DEG C
Comments: OTHER NOTES: TANDEM MASS SPECTROMETRY DATA INDEPENDENTLY GENERATED BY SCRIPPS CENTER FOR METABOLOMICS IS AVAILABLE TO VIEW OR DOWNLOAD IN PDF. 706418.PDF TESTED METABOLITES ARE FEATURED ON SCRIPPS CENTER FOR METABOLOMICS METLIN METABOLITE DATABASE. TO LEARN MORE, VISIT SIGMA.COM/METLIN
RTECS: GV2770000
WGK: 3

secure_info

secure_symbol: GHS05 GHS05 GHS07 GHS07
secure_signal_word: Danger
secure_risk_stmt: H315-H318-H335
secure_cautionary_stmt: P261-P280-P305 + P351 + P338
secure_damage_code: Xi
secure_risk_disclosure_stmt: R:37/38-41
secure_security_stmt: S:26-39
secure_wgk_germany: 3

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