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2752-38-7

2752-38-7 | L-Proline, 1-(2-phenylacetyl)-

CAS No: 2752-38-7 Catalog No: AG002U0M MDL No:MFCD08310539

Product Description

Catalog Number:
AG002U0M
Chemical Name:
L-Proline, 1-(2-phenylacetyl)-
CAS Number:
2752-38-7
Molecular Formula:
C13H15NO3
Molecular Weight:
233.2631
MDL Number:
MFCD08310539
IUPAC Name:
(2S)-1-(2-phenylacetyl)pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C13H15NO3/c15-12(9-10-5-2-1-3-6-10)14-8-4-7-11(14)13(16)17/h1-3,5-6,11H,4,7-9H2,(H,16,17)/t11-/m0/s1
InChI Key:
UBQCWSGRNIOFFC-NSHDSACASA-N
SMILES:
OC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1
EC Number:
928-037-6

Properties

Complexity:
297  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
233.105g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.267g/mol
Monoisotopic Mass:
233.105g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

Literature

Title Journal
alpha-Amino acid derivatives as proton pump inhibitors and potent anti-ulcer agents. European journal of medicinal chemistry 20070301

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