108647-56-9
Benzeneacetic acid, alpha-[[(1,1-dimethylethoxy)carbonyl]amino]-4-formyl-3-hydroxy-, (S)-
NameBenzeneacetic acid, alpha-[[(1,1-dimethylethoxy)carbonyl]amino]-4-formyl-3-hydroxy-, (S)-
1Identification
【Name】
Benzeneacetic acid, alpha-[[(1,1-dimethylethoxy)carbonyl]amino]-4-formyl-3-hydroxy-, (S)-
【CAS】
【MDL】
【English Synonyms】
【Formula】
C14H17NO6
【MolWeight】
295.2879
【Inchi】
InChI=1S/C14H17NO6/c1-14(2,3)21-13(20)15-11(12(18)19)8-4-5-9(7-16)10(17)6-8/h4-7,11,17H,1-3H3,(H,15,20)(H,18,19)/t11-/m0/s1
【InChIKey】
InChIKey=RYDSPHGWMDBSPK-NSHDSACASA-N
【SMILES】
CC(C)(OC(=O)N[C@H](C(=O)O)C1=CC(=C(C=C1)C=O)O)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-formyl-3-hydroxy-, (S)-.cml