(5-chloro-2-methoxyphenyl)hydrazine hydrochloride

• ChemBase ID: 87696
• Molecular Formular: C7H10Cl2N2O
• Molecular Mass: 209.0731
• Monoisotopic Mass: 208.01701831
• SMILES: Cl.N(c1c(ccc(c1)Cl)OC)N
• Canonical SMILES: NNc1cc(Cl)ccc1OC.Cl
• InChI: InChI=1S/C7H9ClN2O.ClH/c1-11-7-3-2-5(8)4-6(7)10-9;/h2-4,10H,9H2,1H3;1H
• InChIKey: GOMLDPWKBMXMEX-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (5-chloro-2-methoxyphenyl)hydrazine hydrochloride
• IUPAC Traditional name: (5-chloro-2-methoxyphenyl)hydrazine hydrochloride
• Synonyms: (5-Chloro-2-methoxyphenyl)hydrazine hydrochloride; 5-Chloro-2-methoxyphenylhydrazine hydrochloride

Database IDs

• MDL Number: MFCD03196500
• PubChem SID: 162074736
• PubChem CID: 2757646

CALCULATED PROPERTIES

• Acid pKa: 17.640862
• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): 1.7444936
• LogD (pH = 7.4): 1.8103541
• Log P: 1.8112619
• Molar Refractivity: 47.0327 cm^3
• Polarizability: 17.288647 Å^3
• Polar Surface Area: 47.28 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: Irritant

Product Information

• Empirical Formula (Hill Notation): C7H10Cl2N2O

DETAILS

Sigma Aldrich - CBR00784

Other Notes
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Legal Information
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