887594-48-1
ALPHA-(3-METHOXYPHENYL)-3-(BOC-AMINO)-1-AZETIDINEACETIC ACID
NameALPHA-(3-METHOXYPHENYL)-3-(BOC-AMINO)-1-AZETIDINEACETIC ACID
1Identification
【Name】
ALPHA-(3-METHOXYPHENYL)-3-(BOC-AMINO)-1-AZETIDINEACETIC ACID
【CAS】
【MDL】
MFCD05662575
【English Synonyms】
【Formula】
C17 H24 N2 O5
【MolWeight】
336.386
【Inchi】
InChI=1S/C17H24N2O5/c1-17(2,3)24-16(22)18-12-9-19(10-12)14(15(20)21)11-6-5-7-13(8-11)23-4/h5-8,12,14H,9-10H2,1-4H3,(H,18,22)(H,20,21)
【InChIKey】
InChIKey=VKUGHSHEXMYCFZ-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)NC1CN(C1)C(c2cccc(c2)OC)C(=O)O
【MOL File】
ALPHA-(3-METHOXYPHEN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ALPHA-(3-METHOXYPHENYL)-3-(BOC-AMINO)-1-AZETIDINEACETIC ACID.cml