tert-butyl N-[(hydrazinecarbonyl)methyl]-N-methylcarbamate

• ChemBase ID: 309865
• Molecular Formular: C8H17N3O3
• Molecular Mass: 203.23888
• Monoisotopic Mass: 203.12699142
• SMILES: C(=O)(N(CC(=O)NN)C)OC(C)(C)C
• Canonical SMILES: NNC(=O)CN(C(=O)OC(C)(C)C)C
• InChI: InChI=1S/C8H17N3O3/c1-8(2,3)14-7(13)11(4)5-6(12)10-9/h5,9H2,1-4H3,(H,10,12)
• InChIKey: VQWBYKYBNLFIPX-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tert-butyl N-[(hydrazinecarbonyl)methyl]-N-methylcarbamate
• IUPAC Traditional name: tert-butyl N-[(hydrazinecarbonyl)methyl]-N-methylcarbamate
• Synonyms: tert-butyl (2-hydrazino-2-oxoethyl)methylcarbamate

Database IDs

• CAS Number: 633328-19-5
• MDL Number: MFCD18074293

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -0.5360685
• LogD (pH = 7.4): -0.5351344
• Log P: -0.5351204
• Molar Refractivity: 52.0794 cm^3
• Polarizability: 20.081818 Å^3
• Polar Surface Area: 84.66 Å^2