2-amino-N-hydroxyacetamide

• ChemBase ID: 153573
• Molecular Formular: C2H6N2O2
• Molecular Mass: 90.08124
• Monoisotopic Mass: 90.04292744
• SMILES: C(C(=O)NO)N
• Canonical SMILES: NCC(=O)NO
• InChI: InChI=1S/C2H6N2O2/c3-1-2(5)4-6/h6H,1,3H2,(H,4,5)
• InChIKey: VDBCTDQYMZSQFQ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-amino-N-hydroxyacetamide
• IUPAC Traditional name: 2-amino-N-hydroxyacetamide
• Synonyms: Glycine hydroxamate

Database IDs

• CAS Number: 5349-80-4
• MDL Number: MFCD00243727
• PubChem SID: 162247712; 24895101
• PubChem CID: 94811

CALCULATED PROPERTIES

• Acid pKa: 8.853476
• H Acceptors: 3
• H Donor: 3
• LogD (pH = 5.5): -4.1561284
• LogD (pH = 7.4): -2.5086963
• Log P: -2.2496278
• Molar Refractivity: 19.5902 cm^3
• Polarizability: 7.884544 Å^3
• Polar Surface Area: 75.35 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• German water hazard class: 3
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
• Storage Temperature: -20°C

Product Information

• Purity: ≥98%
• Empirical Formula (Hill Notation): C2H6N2O2