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Chemical structure of N-acetyl-beta-alanine

GC19712

N-acetyl-beta-alanine

Also known as 3-acetamidopropanoic acid

N-acetyl-beta-alanine (N-Acetyl-β-alanine), an abnormal amino acid metabolite, is a mono-N-protected amino acid (MPAA) ligand

ChemicalCAS3025-95-4MW131.13FormulaC5H9NO3
CAS number
3025-95-4
Molecular weight
131.13
Formula
C5H9NO3
Solubility
>22 mg/mL in EtOH; >40 mg/mL in Water; >60·9 mg/mL in DMSO
InChIKey
LJLLAWRMBZNPMO-UHFFFAOYSA-N
Catalogue number
GC19712
Brand
GLPBIO
Computed properties PubChem CID 76406 · XLogP -1 · TPSA 66.4 Ų · H-bond donors 2
XLogP
-1
TPSA
66.4 Ų
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
9

SMILES CC(=O)NCCC(=O)O

Computed descriptors from PubChem (CID 76406), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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