1375080-54-8
[1,1'-Biphenyl]-4-propanoic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-3'-methyl-, (αS)-
Name[1,1'-Biphenyl]-4-propanoic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-3'-methyl-, (αS)-
1Identification
【Name】
[1,1'-Biphenyl]-4-propanoic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-3'-methyl-, (αS)-
【CAS】
【MDL】
【English Synonyms】
【Formula】
C21H25NO4
【MolWeight】
355.4275
【Inchi】
InChI=1S/C21H25NO4/c1-14-6-5-7-17(12-14)16-10-8-15(9-11-16)13-18(19(23)24)22-20(25)26-21(2,3)4/h5-12,18H,13H2,1-4H3,(H,22,25)(H,23,24)/t18-/m0/s1
【InChIKey】
InChIKey=KHLAORQVZNWBMK-SFHVURJKSA-N
【SMILES】
CC(C)(OC(=O)N[C@H](C(=O)O)CC1=CC=C(C=C1)C1=CC(=CC=C1)C)C
【MOL File】
[1,1'-Biphenyl]-4-pr….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
[1,1'-Biphenyl]-4-propanoic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-3'-methyl-, (αS)-.cml