2-amino-3-hydroxypropanehydrazide hydrochloride

• ChemBase ID: 796755
• Molecular Formular: C3H10ClN3O2
• Molecular Mass: 155.5834
• Monoisotopic Mass: 155.04615426
• SMILES: Cl.C(=O)(C(CO)N)NN
• Canonical SMILES: NC(C(=O)NN)CO.Cl
• InChI: InChI=1S/C3H9N3O2.ClH/c4-2(1-7)3(8)6-5;/h2,7H,1,4-5H2,(H,6,8);1H
• InChIKey: JNWGUZKRVDKZBI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-amino-3-hydroxypropanehydrazide hydrochloride
• IUPAC Traditional name: 2-amino-3-hydroxypropanehydrazide hydrochloride
• Synonyms: 2-AMino-3-hydroxypropanehydrazide hydrochloride

Database IDs

• CAS Number: 55819-71-1

CALCULATED PROPERTIES

• Acid pKa: 12.555232
• H Acceptors: 4
• H Donor: 4
• LogD (pH = 5.5): -4.9657817
• LogD (pH = 7.4): -3.2808886
• Log P: -2.7290397
• Molar Refractivity: 28.3473 cm^3
• Polarizability: 11.127228 Å^3
• Polar Surface Area: 101.37 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 97%