2-[(OXAN-4-YLMETHYL)SULFANYL]BENZOIC ACID

pro_cas
pro_cdbregno
CCD03341509
pro_formula
C13 H16 O3 S
pro_molWeight
252.332

basic_info

Product_Name: 2-[(OXAN-4-YLMETHYL)SULFANYL]BENZOIC ACID
EnglishSynonyms: 2-[(OXAN-4-YLMETHYL)SULFANYL]BENZOIC ACID
pro_mdlNumber: MFCD17063222
pro_acceptors: 3
pro_donors: 1
pro_smile: c1ccc(c(c1)C(=O)O)SCC2CCOCC2
InChi: InChI=1S/C13H16O3S/c14-13(15)11-3-1-2-4-12(11)17-9-10-5-7-16-8-6-10/h1-4,10H,5-9H2,(H,14,15)
InChiKey: InChIKey=VWJMLSIFWMQKAT-UHFFFAOYSA-N

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