Home Carboxys 2,5-Pyrrolidinedicarboxylic acid, 1-(phenylMethyl)-, diMethyl ester

2,5-Pyrrolidinedicarboxylic acid, 1-(phenylMethyl)-, diMethyl ester

CAS No.:
51483-87-5
Catalog Number:
AG00E1VV
Molecular Formula:
C15H19NO4
Molecular Weight:
277.3157
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Product Description
Catalog Number:
AG00E1VV
Chemical Name:
2,5-Pyrrolidinedicarboxylic acid, 1-(phenylMethyl)-, diMethyl ester
CAS Number:
51483-87-5
Molecular Formula:
C15H19NO4
Molecular Weight:
277.3157
MDL Number:
MFCD11502067
IUPAC Name:
dimethyl 1-benzylpyrrolidine-2,5-dicarboxylate
InChI:
InChI=1S/C15H19NO4/c1-19-14(17)12-8-9-13(15(18)20-2)16(12)10-11-6-4-3-5-7-11/h3-7,12-13H,8-10H2,1-2H3
InChI Key:
VOUOTBJQQLQSCY-UHFFFAOYSA-N
SMILES:
COC(=O)C1CCC(N1Cc1ccccc1)C(=O)OC
Properties
Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.131g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.32g/mol
Monoisotopic Mass:
277.131g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties