[(2,3,4-trimethoxyphenyl)methyl]hydrazine hydrochloride

• ChemBase ID: 270982
• Molecular Formular: C10H17ClN2O3
• Molecular Mass: 248.70658
• Monoisotopic Mass: 248.09277009
• SMILES: c1(c(c(ccc1OC)CNN)OC)OC.Cl
• Canonical SMILES: NNCc1ccc(c(c1OC)OC)OC.Cl
• InChI: InChI=1S/C10H16N2O3.ClH/c1-13-8-5-4-7(6-12-11)9(14-2)10(8)15-3;/h4-5,12H,6,11H2,1-3H3;1H
• InChIKey: MNAKEKZCFQRUND-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(2,3,4-trimethoxyphenyl)methyl]hydrazine hydrochloride
• IUPAC Traditional name: [(2,3,4-trimethoxyphenyl)methyl]hydrazine hydrochloride
• Synonyms: [(2,3,4-trimethoxyphenyl)methyl]hydrazine hydrochloride

Database IDs

• MDL Number: MFCD17977042
• PubChem SID: 164326892
• PubChem CID: 50988581

CALCULATED PROPERTIES

• H Acceptors: 5
• H Donor: 2
• LogD (pH = 5.5): 0.287713
• LogD (pH = 7.4): 0.43903014
• Log P: 0.44134504
• Molar Refractivity: 68.8979 cm^3
• Polarizability: 22.583042 Å^3
• Polar Surface Area: 65.74 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.0040

Product Information

• Purity: 95%