(3-ethylphenyl)hydrazine hydrochloride

• ChemBase ID: 811074
• Molecular Formular: C8H13ClN2
• Molecular Mass: 172.65522
• Monoisotopic Mass: 172.07672611
• SMILES: Cl.NNc1cc(ccc1)CC
• Canonical SMILES: CCc1cccc(c1)NN.Cl
• InChI: InChI=1S/C8H12N2.ClH/c1-2-7-4-3-5-8(6-7)10-9;/h3-6,10H,2,9H2,1H3;1H
• InChIKey: JWJSWCNKBBQJMP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (3-ethylphenyl)hydrazine hydrochloride
• IUPAC Traditional name: (3-ethylphenyl)hydrazine hydrochloride
• Synonyms: (3-ETHYL-PHENYL)-HYDRAZINE HYDROCHLORIDE

Database IDs

• CAS Number: 60481-49-4

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 2.078115
• LogD (pH = 7.4): 2.3187573
• Log P: 2.3228786
• Molar Refractivity: 45.4069 cm^3
• Polarizability: 16.517769 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%