(4-ethoxyphenyl)hydrazine hydrochloride

• ChemBase ID: 34657
• Molecular Formular: C8H13ClN2O
• Molecular Mass: 188.65462
• Monoisotopic Mass: 188.07164073
• SMILES: N(c1ccc(cc1)OCC)N.Cl
• Canonical SMILES: CCOc1ccc(cc1)NN.Cl
• InChI: InChI=1S/C8H12N2O.ClH/c1-2-11-8-5-3-7(10-9)4-6-8;/h3-6,10H,2,9H2,1H3;1H
• InChIKey: RROBGBQPYPYDFT-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (4-ethoxyphenyl)hydrazine hydrochloride
• IUPAC Traditional name: (4-ethoxyphenyl)hydrazine hydrochloride
• Synonyms: (4-Ethoxyphenyl)hydrazine hydrochloride

Database IDs

• MDL Number: MFCD12403348
• PubChem SID: 160997964
• PubChem CID: 12489802

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): 1.3418322
• LogD (pH = 7.4): 1.5603865
• Log P: 1.5640252
• Molar Refractivity: 46.9765 cm^3
• Polarizability: 17.248121 Å^3
• Polar Surface Area: 47.28 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 139 - 141°C
• Hydrophobicity(logP): 1.897

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: 95%