Name: Name:N-Carbamoyl-2-fluoro-b-alanine
Brand: Angene
SKU: AG00DEU8
Rating: 90 (10 reviews)

N-Carbamoyl-2-fluoro-b-alanine

CAS No.:

5006-64-4

Catalog Number:

AG00DEU8

Molecular Formula:

Molecular Weight:

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Product Description

Catalog Number:

AG00DEU8

Chemical Name:

N-Carbamoyl-2-fluoro-b-alanine

CAS Number:

5006-64-4

MDL Number:

MFCD18379254

IUPAC Name:

3-(carbamoylamino)-2-fluoropropanoic acid

InChI:

InChI=1S/C4H7FN2O3/c5-2(3(8)9)1-7-4(6)10/h2H,1H2,(H,8,9)(H3,6,7,10)

InChI Key:

FKTHAKABFGARQH-UHFFFAOYSA-N

Properties

Complexity:

149

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

150.044g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

150.109g/mol

Monoisotopic Mass:

150.044g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

92.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.1

Literature

Title	Journal
The achievement of mass balance by simultaneous quantification of floxuridine prodrug, floxuridine, 5-fluorouracil, 5-dihydrouracil, α-fluoro-β-ureidopropionate, α-fluoro-β-alanine using LC-MS.	Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20110415
Metabolism of capecitabine, an oral fluorouracil prodrug: (19)F NMR studies in animal models and human urine.	Drug metabolism and disposition: the biological fate of chemicals 20021101