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1103894-65-0 | 4-hydroxy-1-(2-phenoxyacetyl)pyrrolidine-2-carboxylic acid
CAS No: 1103894-65-0 Catalog No: AG01EKKG MDL No:MFCD12444906
Product Description
Catalog Number:
AG01EKKG
Chemical Name:
4-hydroxy-1-(2-phenoxyacetyl)pyrrolidine-2-carboxylic acid
CAS Number:
1103894-65-0
Molecular Formula:
C13H15NO5
Molecular Weight:
265.2619
MDL Number:
MFCD12444906
IUPAC Name:
4-hydroxy-1-(2-phenoxyacetyl)pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C13H15NO5/c15-9-6-11(13(17)18)14(7-9)12(16)8-19-10-4-2-1-3-5-10/h1-5,9,11,15H,6-8H2,(H,17,18)
InChI Key:
QJDOKHSEVVYVPW-UHFFFAOYSA-N
SMILES:
OC1CN(C(C1)C(=O)O)C(=O)COc1ccccc1
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.095g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
265.265g/mol
Monoisotopic Mass:
265.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
87.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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