2,3-dihydro-1H-inden-2-ylhydrazine dihydrochloride

• ChemBase ID: 15565
• Molecular Formular: C9H14Cl2N2
• Molecular Mass: 221.12686
• Monoisotopic Mass: 220.05340382
• SMILES: C1(NN)Cc2c(C1)cccc2.Cl.Cl
• Canonical SMILES: NNC1Cc2c(C1)cccc2.Cl.Cl
• InChI: InChI=1S/C9H12N2.2ClH/c10-11-9-5-7-3-1-2-4-8(7)6-9;;/h1-4,9,11H,5-6,10H2;2*1H
• InChIKey: AHTFDEKRFAPYHI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,3-dihydro-1H-inden-2-ylhydrazine dihydrochloride
• IUPAC Traditional name: 2,3-dihydro-1H-inden-2-ylhydrazine dihydrochloride
• Synonyms: 2,3-Dihydro-1H-inden-2-ylhydrazine dihydrochloride

Database IDs

• MDL Number: MFCD06800571
• PubChem SID: 160978872
• PubChem CID: 45074972

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 0.94527286
• LogD (pH = 7.4): 1.2957419
• Log P: 1.3026756
• Molar Refractivity: 57.2431 cm^3
• Polarizability: 17.84261 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false