[(2E)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ylidene]hydrazine

• ChemBase ID: 251102
• Molecular Formular: C10H18N2
• Molecular Mass: 166.26332
• Monoisotopic Mass: 166.14699859
• SMILES: C12(C(C(C/C/1=N\N)CC2)(C)C)C
• Canonical SMILES: N/N=C/1\CC2C(C1(C)CC2)(C)C
• InChI: InChI=1S/C10H18N2/c1-9(2)7-4-5-10(9,3)8(6-7)12-11/h7H,4-6,11H2,1-3H3/b12-8+
• InChIKey: PEGOJPQIBGLFFN-XYOKQWHBSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(2E)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ylidene]hydrazine
• IUPAC Traditional name: [(2E)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ylidene]hydrazine
• Synonyms: (2E)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one hydrazone

Database IDs

• MDL Number: MFCD07197207
• PubChem SID: 164307012
• PubChem CID: 12526705

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 2.22944
• LogD (pH = 7.4): 2.268648
• Log P: 2.2691715
• Molar Refractivity: 51.0332 cm^3
• Polarizability: 19.8518 Å^3
• Polar Surface Area: 38.38 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 2.547

Product Information

• Purity: 95%