Home Other Building Blocks (2S,4R)-1-benzoyl-4-hydroxypyrrolidine-2-carboxamide

(2S,4R)-1-benzoyl-4-hydroxypyrrolidine-2-carboxamide

CAS No.:
1955474-53-9
Catalog Number:
AG01C5P8
Molecular Formula:
C12H14N2O3
Molecular Weight:
234.2512
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Product Description
Catalog Number:
AG01C5P8
Chemical Name:
(2S,4R)-1-benzoyl-4-hydroxypyrrolidine-2-carboxamide
CAS Number:
1955474-53-9
Molecular Formula:
C12H14N2O3
Molecular Weight:
234.2512
MDL Number:
MFCD29991463
IUPAC Name:
1-benzoyl-4-hydroxypyrrolidine-2-carboxamide
InChI:
InChI=1S/C12H14N2O3/c13-11(16)10-6-9(15)7-14(10)12(17)8-4-2-1-3-5-8/h1-5,9-10,15H,6-7H2,(H2,13,16)
InChI Key:
QYKCILOZAVMTLT-UHFFFAOYSA-N
SMILES:
O[C@@H]1C[C@H](N(C1)C(=O)c1ccccc1)C(=O)N
Properties
Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.1g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
234.255g/mol
Monoisotopic Mass:
234.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties