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Basic Information |
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Product Name: | 2-CYCLOHEXYLMANDELIC ACID |
CAS: | 50896-04-3 ;4335-77-7 |
English Synonyms: | ALPHA-CYCLOHEXYL-DL-MANDELIC ACID ; CYCLOHEXYL-HYDROXY-PHENYL-ACETIC ACID ; CYCLOHEXYLPHENYLGLYCOLIC ACID ; ALPHA-CYCLOHEXYLMANDELIC ACID ; A-CYCLOHEXYL-A-HYDROXYPHENYL ACETIC ACID ; CYCLOHEXYLMANDELIC ACID, 98% ; A-CYCLOHEXYLMANDELIC ACID ; 2-CYCLOHEXYL-2-HYDROXY-PHENYLACETIC ACID,WHITE SOLID ; ALPHA-CYCLOHEXYL-ALPHA-HYDROXYPHENYL ACETIC ACID ; 2-CYCLOHEXYL-2-PHENYLGLYCOLIC ACID ; CYCLOHEXYLMANDELIC ACID ; 2-CYCLOHEXYL-2-HYDROXY-2-PHENYLACETIC ACID ; 2-CYCLOHEXYL-2-HYDROXY-PHENYLACETIC ACID ; 2-CYCLOHEXYLMANDELIC ACID |
MDL Number.: | MFCD00194543 |
H bond acceptor: | 3 |
H bond donor: | 2 |
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 |
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Melting Point: | 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 |
Safety information |
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Symbol: | GHS05 GHS07 |
Signal word: | Danger |
Hazard statements: | H315-H318-H335 |
Precautionary statements: | P261-P280-P305 + P351 + P338 |
hazard symbol: | Xi |
Risk Code: | R:37/38-41 |
Safe Code: | S:26-39 |
WGK Germany: | 3 |
* If the product has intellectual property rights, a license granted is must or contact us.