Basic information
- CAS
75268-08-5- Standard SMILES
C#CCN(C)N=C(C)C- InChIKey
DACHQBBVFBDBSA-UHFFFAOYSA-N- Molecular formula
- C7H12N2
- Average molar mass
- 124.18 g/mol
- Monoisotopic mass
- 124.10004839
Names & identifiers
- Preferred name
- 2-Propanone, methyl-2-propynylhydrazone
- IUPAC
- N-methyl-N-(propan-2-ylideneamino)prop-2-yn-1-amine
- English name
- 2-Propanone methyl(2-propynyl)hydrazone
- Molecular formula
- C7H12N2
- Molecular weight
- 124.18
Names & synonyms
2-Propanone, methyl-2-propynylhydrazone75268-08-5SCHEMBL4547141DACHQBBVFBDBSA-UHFFFAOYSA-NDTXSID201346221Acetone methyl(2-propynyl)hydrazone #METHYLPROPARGYLHYDRAZONE ACETONE2-Isopropylidene-1-methyl-1-(2-propyn-1-yl)hydrazineAcetone methylpropargyl hydrazone2-Propanone methyl(2-propynyl)hydrazone
Database identifiers
- CAS
75268-08-5- PubChem CID
- 559031
- DTXSID
DTXSID201346221- Nikkaji
- J47.421E
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 15.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 146
Physicochemical properties
- Boiling point
- 160.706 · 160.706±42.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.791 · 0.791±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 4.82 · 4.820±0.70(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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