hydrogen (3,4-dimethylphenyl)hydrazine chloride

• ChemBase ID: 293973
• Molecular Formular: C8H12ClN2-
• Molecular Mass: 171.64728
• Monoisotopic Mass: 171.06890107
• SMILES: c1c(NN)cc(c(c1)C)C.[Cl-]
• Canonical SMILES: NNc1ccc(c(c1)C)C.[Cl-]
• InChI: InChI=1S/C8H12N2.ClH/c1-6-3-4-8(10-9)5-7(6)2;/h3-5,10H,9H2,1-2H3;1H/p-1
• InChIKey: YYMIOVAEQIEPET-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: hydrogen (3,4-dimethylphenyl)hydrazine chloride
• IUPAC Traditional name: hydrogen (3,4-dimethylphenyl)hydrazine chloride
• Synonyms: 3,4-Dimethylphenylhydrazine hydrochloride

Database IDs

• CAS Number: 60481-51-8
• MDL Number: MFCD00052270
• PubChem SID: 180679504
• PubChem CID: 51064107

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 2.1290133
• LogD (pH = 7.4): 2.387208
• Log P: 2.3917313
• Molar Refractivity: 45.8471 cm^3
• Polarizability: 16.437426 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%