2-(morpholin-4-yl)acetohydrazide

• ChemBase ID: 57322
• Molecular Formular: C6H13N3O2
• Molecular Mass: 159.18632
• Monoisotopic Mass: 159.10077667
• SMILES: C(=O)(CN1CCOCC1)NN
• Canonical SMILES: NNC(=O)CN1CCOCC1
• InChI: InChI=1S/C6H13N3O2/c7-8-6(10)5-9-1-3-11-4-2-9/h1-5,7H2,(H,8,10)
• InChIKey: YCEXZVLTZDWEFH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(morpholin-4-yl)acetohydrazide
• IUPAC Traditional name: 2-(morpholin-4-yl)acetohydrazide
• Synonyms: 2-Morpholin-4-ylacetohydrazide

Database IDs

• CAS Number: 770-17-2
• MDL Number: MFCD02269932
• PubChem SID: 162062085
• PubChem CID: 351635

CALCULATED PROPERTIES

• Acid pKa: 12.714917
• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): -2.0828707
• LogD (pH = 7.4): -1.6628975
• Log P: -1.653766
• Molar Refractivity: 41.4535 cm^3
• Polarizability: 15.954764 Å^3
• Polar Surface Area: 67.59 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false