Name: Name:1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid
Brand: Angene
SKU: AG01EKHJ
Rating: 90 (10 reviews)

1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid

CAS No.:

87341-45-5

Catalog Number:

AG01EKHJ

Molecular Formula:

C13H15NO3

Molecular Weight:

233.2631

Catalog Number:

AG01EKHJ

Chemical Name:

1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid

CAS Number:

87341-45-5

Molecular Formula:

C13H15NO3

Molecular Weight:

233.2631

MDL Number:

MFCD03414586

IUPAC Name:

1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid

InChI:

InChI=1S/C13H15NO3/c1-9-2-4-10(5-3-9)8-14-11(13(16)17)6-7-12(14)15/h2-5,11H,6-8H2,1H3,(H,16,17)

InChI Key:

OJKNXYHTQNXSEG-UHFFFAOYSA-N

SMILES:

OC(=O)C1CCC(=O)N1Cc1ccc(cc1)C

Complexity:

308

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

233.105g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.267g/mol

Monoisotopic Mass:

233.105g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3