55767-14-1
Benzeneacetic acid, alpha-[[(1,1-dimethylethoxy)carbonyl]amino]-4-[[2-(1,1-dimethylethoxy)-2-oxoethyl]thio]-, (R)-
NameBenzeneacetic acid, alpha-[[(1,1-dimethylethoxy)carbonyl]amino]-4-[[2-(1,1-dimethylethoxy)-2-oxoethyl]thio]-, (R)-
1Identification
【Name】
Benzeneacetic acid, alpha-[[(1,1-dimethylethoxy)carbonyl]amino]-4-[[2-(1,1-dimethylethoxy)-2-oxoethyl]thio]-, (R)-
【CAS】
【MDL】
【English Synonyms】
【Formula】
C19H27NO6S
【MolWeight】
397.486
【Inchi】
InChI=1S/C19H27NO6S/c1-18(2,3)25-14(21)11-27-13-9-7-12(8-10-13)15(16(22)23)20-17(24)26-19(4,5)6/h7-10,15H,11H2,1-6H3,(H,20,24)(H,22,23)/t15-/m1/s1
【InChIKey】
InChIKey=ZEUSHLQXLBTROO-OAHLLOKOSA-N
【SMILES】
CC(C)(OC(=O)N[C@@H](C(=O)O)C1=CC=C(C=C1)SCC(=O)OC(C)(C)C)C
【MOL File】
Benzeneacetic acid, ….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
Benzeneacetic acid, alpha-[[(1,1-dimethylethoxy)carbonyl]amino]-4-[[2-(1,1-dimethylethoxy)-2-oxoethyl]thio]-, (R)-.cml