Home Carboxys 1-Phenyl-3-pyrrolidinecarboxylic acid

1-Phenyl-3-pyrrolidinecarboxylic acid

CAS No.:
933709-26-3
Catalog Number:
AG00GYN2
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
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Product Description
Catalog Number:
AG00GYN2
Chemical Name:
1-Phenyl-3-pyrrolidinecarboxylic acid
CAS Number:
933709-26-3
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
MDL Number:
MFCD09864921
IUPAC Name:
1-phenylpyrrolidine-3-carboxylic acid
InChI:
InChI=1S/C11H13NO2/c13-11(14)9-6-7-12(8-9)10-4-2-1-3-5-10/h1-5,9H,6-8H2,(H,13,14)
InChI Key:
IOFLKIRLUFZCHR-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCN(C1)c1ccccc1
Properties
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties