2-ethoxyacetohydrazide

• ChemBase ID: 23635
• Molecular Formular: C4H10N2O2
• Molecular Mass: 118.1344
• Monoisotopic Mass: 118.07422757
• SMILES: C(=O)(NN)COCC
• Canonical SMILES: CCOCC(=O)NN
• InChI: InChI=1S/C4H10N2O2/c1-2-8-3-4(7)6-5/h2-3,5H2,1H3,(H,6,7)
• InChIKey: NBPLLPBYZXYAMN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-ethoxyacetohydrazide
• IUPAC Traditional name: 2-ethoxyacetohydrazide
• Synonyms: 2-Ethoxyacetohydrazide

Database IDs

• CAS Number: 39242-95-0
• MDL Number: MFCD08061555
• PubChem SID: 160986942
• PubChem CID: 14750209

CALCULATED PROPERTIES

• Acid pKa: 12.587734
• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -1.1463277
• LogD (pH = 7.4): -1.1441088
• Log P: -1.1440777
• Molar Refractivity: 30.152 cm^3
• Polarizability: 11.485321 Å^3
• Polar Surface Area: 64.35 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -1.124

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: 95%