2,2-dimethylcyclopropane-1-carbohydrazide

• ChemBase ID: 308741
• Molecular Formular: C6H12N2O
• Molecular Mass: 128.17228
• Monoisotopic Mass: 128.09496301
• SMILES: C1(C(C1)C(=O)NN)(C)C
• Canonical SMILES: NNC(=O)C1CC1(C)C
• InChI: InChI=1S/C6H12N2O/c1-6(2)3-4(6)5(9)8-7/h4H,3,7H2,1-2H3,(H,8,9)
• InChIKey: TYIORGRYOXWJCU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,2-dimethylcyclopropane-1-carbohydrazide
• IUPAC Traditional name: 2,2-dimethylcyclopropane-1-carbohydrazide
• Synonyms: 2,2-dimethylcyclopropanecarbohydrazide

Database IDs

• CAS Number: 1211807-78-1
• MDL Number: MFCD12827485

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 0.037588548
• LogD (pH = 7.4): 0.040066026
• Log P: 0.040098418
• Molar Refractivity: 35.3729 cm^3
• Polarizability: 13.696704 Å^3
• Polar Surface Area: 55.12 Å^2