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88500-44-1 | L-Proline, 1-[1-[N-[bis(phenylmethoxy)phosphinyl]glycyl]-L-prolyl]-
CAS No: 88500-44-1 Catalog No: AG004956 MDL No:
Product Description
Catalog Number:
AG004956
Chemical Name:
L-Proline, 1-[1-[N-[bis(phenylmethoxy)phosphinyl]glycyl]-L-prolyl]-
CAS Number:
88500-44-1
Molecular Formula:
C26H32N3O7P
Molecular Weight:
529.5219
IUPAC Name:
1-[1-[2-[bis(phenylmethoxy)phosphorylamino]acetyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C26H32N3O7P/c30-24(28-15-7-13-22(28)25(31)29-16-8-14-23(29)26(32)33)17-27-37(34,35-18-20-9-3-1-4-10-20)36-19-21-11-5-2-6-12-21/h1-6,9-12,22-23H,7-8,13-19H2,(H,27,34)(H,32,33)
InChI Key:
LGSNEFXBCNORLZ-UHFFFAOYSA-N
SMILES:
OC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNP(=O)(OCc1ccccc1)OCc1ccccc1
Properties
Complexity:
818
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
529.198g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
529.53g/mol
Monoisotopic Mass:
529.198g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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