PABA

CAS No.
179258-52-7
CCD No.
CCD00660787
Formula
C17 H28 N3 O8 P S
MolWeight
465.461

Basic Information

Product Name: PABA
CAS: 179258-52-7
English Synonyms: 4-THIAZOLEACETIC ACID, 2-AMINO-ALPHA-[[2-(1,1-DIMETHYLETHOXY)-1,1-DIMETHYL-2-OXOETHOXY]IMINO]-, ANHYDRIDE WITH DIETHYL HYDROGEN PHOSPHATE, (Z)- ; O,O-DIETHYLPHOSPHORYL (Z)-2-(2-AMINOTHIAZOL-4-YL)-2-(1-T-BUTOXYCARBONYL-1-METHYL)ETHOXYIMINOACETATE ; 4-THIAZOLEACETIC ACID, 2-AMINO-A-[[2-(1,1-DIMETHYLETHOXY)-1,1-DIMETHYL-2-OXOETHOXY]IMINO]-, ANHYDRIDE WITH DIETHYL HYDROGEN PHOSPHATE ; PABA
MDL Number.: MFCD08460135
H bond acceptor: 11
H bond donor: 1
Smile: CCOP(=O)(OCC)OC(=O)/C(=N\OC(C)(C)C(=O)OC(C)(C)C)/c1csc(n1)N
InChi: InChI=1S/C17H28N3O8PS/c1-8-24-29(23,25-9-2)27-13(21)12(11-10-30-15(18)19-11)20-28-17(6,7)14(22)26-16(3,4)5/h10H,8-9H2,1-7H3,(H2,18,19)/b20-12-
InChiKey: InChIKey=PEBPIOCFTYBZMA-NDENLUEZSA-N

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