78700-03-5
Benzenepentanoic acid, alpha-amino-4-(phenylmethoxy)-, (S)- (9CI)
NameBenzenepentanoic acid, alpha-amino-4-(phenylmethoxy)-, (S)- (9CI)
1Identification
【Name】
Benzenepentanoic acid, alpha-amino-4-(phenylmethoxy)-, (S)- (9CI)
【CAS】
【MDL】
【English Synonyms】
【Formula】
C18H21NO3
【MolWeight】
299.3642
【Inchi】
InChI=1S/C18H21NO3/c19-17(18(20)21)8-4-7-14-9-11-16(12-10-14)22-13-15-5-2-1-3-6-15/h1-3,5-6,9-12,17H,4,7-8,13,19H2,(H,20,21)/t17-/m0/s1
【InChIKey】
InChIKey=CBHDPABBKZYROF-KRWDZBQOSA-N
【SMILES】
N[C@H](C(=O)O)CCCC1=CC=C(C=C1)OCC1=CC=CC=C1
【MOL File】
Benzenepentanoic aci….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
Benzenepentanoic acid, alpha-amino-4-(phenylmethoxy)-, (S)- (9CI).cml