Name: Name:3-[(2-oxo-2-phenylethyl)carbamoyl]propanoic acid
Brand: Angene
SKU: AG019XJ4
Rating: 90 (10 reviews)

3-[(2-oxo-2-phenylethyl)carbamoyl]propanoic acid

CAS No.:

24246-92-2

Catalog Number:

AG019XJ4

Molecular Formula:

C12H13NO4

Molecular Weight:

235.2359

Catalog Number:

AG019XJ4

Chemical Name:

3-[(2-oxo-2-phenylethyl)carbamoyl]propanoic acid

CAS Number:

24246-92-2

Molecular Formula:

C12H13NO4

Molecular Weight:

235.2359

MDL Number:

MFCD00207941

IUPAC Name:

4-oxo-4-(phenacylamino)butanoic acid

InChI:

InChI=1S/C12H13NO4/c14-10(9-4-2-1-3-5-9)8-13-11(15)6-7-12(16)17/h1-5H,6-8H2,(H,13,15)(H,16,17)

InChI Key:

DCAKUOVISGPERC-UHFFFAOYSA-N

SMILES:

O=C(NCC(=O)c1ccccc1)CCC(=O)O

Complexity:

295

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

235.084g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

235.239g/mol

Monoisotopic Mass:

235.084g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3