1196466-54-2
Benzenebutanoic acid, 3-chloro-beta-[[(1,1-dimethylethoxy)carbonyl]amino]-4-methoxy-, (betaR)-
NameBenzenebutanoic acid, 3-chloro-beta-[[(1,1-dimethylethoxy)carbonyl]amino]-4-methoxy-, (betaR)-
1Identification
【Name】
Benzenebutanoic acid, 3-chloro-beta-[[(1,1-dimethylethoxy)carbonyl]amino]-4-methoxy-, (betaR)-
【CAS】
【MDL】
【English Synonyms】
【Formula】
C16H22ClNO5
【MolWeight】
343.803
【Inchi】
InChI=1S/C16H22ClNO5/c1-16(2,3)23-15(21)18-11(9-14(19)20)7-10-5-6-13(22-4)12(17)8-10/h5-6,8,11H,7,9H2,1-4H3,(H,18,21)(H,19,20)/t11-/m1/s1
【InChIKey】
InChIKey=NUSJQLPMFPNDEV-LLVKDONJSA-N
【SMILES】
ClC=1C=C(C=CC1OC)C[C@H](CC(=O)O)NC(=O)OC(C)(C)C
【MOL File】
Benzenebutanoic 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
Benzenebutanoic acid, 3-chloro-beta-[[(1,1-dimethylethoxy)carbonyl]amino]-4-methoxy-, (betaR)-.cml