952661-13-1
N-FMOC-2-BENZYL-3-(2-AZEPANYL-HYDROXYPHOSPHINOYL)PROPIONIC ACID
NameN-FMOC-2-BENZYL-3-(2-AZEPANYL-HYDROXYPHOSPHINOYL)PROPIONIC ACID
1Identification
【Name】
N-FMOC-2-BENZYL-3-(2-AZEPANYL-HYDROXYPHOSPHINOYL)PROPIONIC ACID
【CAS】
【MDL】
MFCD11707075
【English Synonyms】
【Formula】
C31 H34 N O6 P
【MolWeight】
547.585
【Inchi】
InChI=1S/C31H34NO6P/c33-30(34)23(19-22-11-3-1-4-12-22)21-39(36,37)29-17-5-2-10-18-32(29)31(35)38-20-28-26-15-8-6-13-24(26)25-14-7-9-16-27(25)28/h1,3-4,6-9,11-16,23,28-29H,2,5,10,17-21H2,(H,33,34)(H,36,37)
【InChIKey】
InChIKey=IDWSLXUQIANLLK-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)CC(CP(=O)(C2CCCCCN2C(=O)OCC3c4ccccc4-c5c3cccc5)O)C(=O)O
【MOL File】
N-FMOC-2-BENZYL-3-(2….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-FMOC-2-BENZYL-3-(2-AZEPANYL-HYDROXYPHOSPHINOYL)PROPIONIC ACID.cml