Name: Name:1-(4-methylphenyl)-2-oxopyrrolidine-3-carboxylic acid
Brand: Angene
SKU: AG00EKV5
Rating: 90 (10 reviews)

1-(4-methylphenyl)-2-oxopyrrolidine-3-carboxylic acid

CAS No.:

618070-29-4

Catalog Number:

AG00EKV5

Molecular Formula:

C12H13NO3

Molecular Weight:

219.2365

Catalog Number:

AG00EKV5

Chemical Name:

1-(4-methylphenyl)-2-oxopyrrolidine-3-carboxylic acid

CAS Number:

618070-29-4

Molecular Formula:

C12H13NO3

Molecular Weight:

219.2365

MDL Number:

MFCD03932870

IUPAC Name:

1-(4-methylphenyl)-2-oxopyrrolidine-3-carboxylic acid

InChI:

InChI=1S/C12H13NO3/c1-8-2-4-9(5-3-8)13-7-6-10(11(13)14)12(15)16/h2-5,10H,6-7H2,1H3,(H,15,16)

InChI Key:

BQAYIKBVMPQAFU-UHFFFAOYSA-N

SMILES:

OC(=O)C1CCN(C1=O)c1ccc(cc1)C

Complexity:

295

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

219.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

219.24g/mol

Monoisotopic Mass:

219.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1