(2,4,6-trimethylphenyl)hydrazine

• ChemBase ID: 232671
• Molecular Formular: C9H14N2
• Molecular Mass: 150.22086
• Monoisotopic Mass: 150.11569846
• SMILES: c1(c(cc(cc1C)C)C)NN
• Canonical SMILES: NNc1c(C)cc(cc1C)C
• InChI: InChI=1S/C9H14N2/c1-6-4-7(2)9(11-10)8(3)5-6/h4-5,11H,10H2,1-3H3
• InChIKey: PVKZANLHDRKRQR-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2,4,6-trimethylphenyl)hydrazine
• IUPAC Traditional name: (2,4,6-trimethylphenyl)hydrazine
• Synonyms: mesitylhydrazine

Database IDs

• CAS Number: 13636-54-9
• MDL Number: MFCD02663067
• PubChem SID: 164288581
• PubChem CID: 735803

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 2.64444
• LogD (pH = 7.4): 2.900675
• Log P: 2.9051526
• Molar Refractivity: 50.8883 cm^3
• Polarizability: 18.204092 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 2.762

Product Information

• Purity: 95%