propan-2-ylhydrazine

• ChemBase ID: 17885
• Molecular Formular: C3H10N2
• Molecular Mass: 74.1249
• Monoisotopic Mass: 74.08439833
• SMILES: N(N)C(C)C
• Canonical SMILES: NNC(C)C
• InChI: InChI=1S/C3H10N2/c1-3(2)5-4/h3,5H,4H2,1-2H3
• InChIKey: KJAQRHMKLVGSCG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: propan-2-ylhydrazine
• IUPAC Traditional name: isopropylhydrazine
• Synonyms: Isopropyl-hydrazine; isopropylhydrazine oxalate; isopropylhydrazine

Database IDs

• CAS Number: 2257-52-5
• MDL Number: MFCD07783355; MFCD03410233
• PubChem SID: 160981192
• PubChem CID: 52789

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -0.6075512
• LogD (pH = 7.4): -0.049974866
• Log P: -0.0367313
• Molar Refractivity: 34.0631 cm^3
• Polarizability: 9.113097 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Partition Coefficient: -0.178

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: 95+%
• Salt Data: (COOH)2