Basic information
- CAS
118398-99-5- Standard SMILES
CCNN=NC- InChIKey
JPDFQGLVHBSJAS-UHFFFAOYSA-N- Molecular formula
- C3H9N3
- Average molar mass
- 87.12 g/mol
- Monoisotopic mass
- 87.0796473
Names & identifiers
- Preferred name
- 1-Ethyl-3-methyltriazene
- IUPAC
- N-(methyldiazenyl)ethanamine
- English name
- N-methyldiazenylethanamine
- Molecular formula
- C3H9N3
- Molecular weight
- 87.12
Names & synonyms
1-Ethyl-3-methyltriazene118398-99-5DTXSID90152108RefChem:230318DTXCID1074599N-(methyldiazenyl)ethanamineN-METHYLDIAZENYLETHANAMINESCHEMBL806037SCHEMBL8710940SCHEMBL14665230(1E)-3-Ethyl-1-methyltriaz-1-ene1-Triazene, 3-ethyl-1-methyl-
Database identifiers
- CAS
118398-99-5- PubChem CID
- 147248
- DTXSID
DTXSID90152108- Nikkaji
- J928.004I
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 36.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 41.3
Physicochemical properties
- Boiling point
- 81.259 · 81.259±23.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.941 · 0.941±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 9.775 · 9.775±0.70(predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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