Home Carboxys 1-Pyrrolidinecarboxylic acid, phenylmethyl ester

1-Pyrrolidinecarboxylic acid, phenylmethyl ester

CAS No.:
25070-74-0
Catalog Number:
AG002QED
Molecular Formula:
C12H15NO2
Molecular Weight:
205.2530
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Product Description
Catalog Number:
AG002QED
Chemical Name:
1-Pyrrolidinecarboxylic acid, phenylmethyl ester
CAS Number:
25070-74-0
Molecular Formula:
C12H15NO2
Molecular Weight:
205.2530
MDL Number:
MFCD18206031
IUPAC Name:
benzyl pyrrolidine-1-carboxylate
InChI:
InChI=1S/C12H15NO2/c14-12(13-8-4-5-9-13)15-10-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2
InChI Key:
VALPXRNQZYGXPS-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC1)OCc1ccccc1
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.11g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.257g/mol
Monoisotopic Mass:
205.11g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties