(naphthalen-1-ylmethyl)hydrazine

• ChemBase ID: 117845
• Molecular Formular: C11H12N2
• Molecular Mass: 172.22638
• Monoisotopic Mass: 172.10004839
• SMILES: c12c(CNN)cccc1cccc2
• Canonical SMILES: NNCc1cccc2c1cccc2
• InChI: InChI=1S/C11H12N2/c12-13-8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7,13H,8,12H2
• InChIKey: ZCHQLJHNQLLRNW-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (naphthalen-1-ylmethyl)hydrazine
• IUPAC Traditional name: (naphthalen-1-ylmethyl)hydrazine
• Synonyms: (1-naphthylmethyl)hydrazine hydrochloride

Database IDs

• MDL Number: MFCD16660416
• PubChem SID: 162089492
• PubChem CID: 16778391

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 1.6655004
• LogD (pH = 7.4): 1.8998543
• Log P: 1.9038355
• Molar Refractivity: 65.9585 cm^3
• Polarizability: 22.67755 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Partition Coefficient: 2.027

Product Information

• Purity: 95+%
• Salt Data: HCl