hydrogen (3-methylphenyl)hydrazine chloride

• ChemBase ID: 293717
• Molecular Formular: C7H10ClN2-
• Molecular Mass: 157.6207
• Monoisotopic Mass: 157.05325101
• SMILES: c1c(NN)cccc1C.[Cl-]
• Canonical SMILES: NNc1cccc(c1)C.[Cl-]
• InChI: InChI=1S/C7H10N2.ClH/c1-6-3-2-4-7(5-6)9-8;/h2-5,9H,8H2,1H3;1H/p-1
• InChIKey: SHTBTGXNVWYODU-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: hydrogen (3-methylphenyl)hydrazine chloride
• IUPAC Traditional name: hydrogen (3-methylphenyl)hydrazine chloride
• Synonyms: 3-Methylphenylhydrazine hydrochloride

Database IDs

• CAS Number: 637-04-7
• MDL Number: MFCD00012932
• PubChem SID: 180679248
• PubChem CID: 51064108

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 1.6303076
• LogD (pH = 7.4): 1.8741173
• Log P: 1.8783098
• Molar Refractivity: 40.8059 cm^3
• Polarizability: 14.672173 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%