Basic information
- CAS
877055-27-1- Standard SMILES
O=C(CC1N=NN=N1)N1CCOCC1- InChIKey
NPNURFBLFZPGPK-UHFFFAOYSA-N- Molecular formula
- C7H11N5O2
- Average molar mass
- 197.19 g/mol
Names & identifiers
- Preferred name
- 1-morpholin-4-yl-2-(5H-tetrazol-5-yl)ethanone
- IUPAC
- 1-morpholin-4-yl-2-(5H-tetrazol-5-yl)ethanone
- English name
- 4-(2H-tetraazol-5-ylacetyl)morpholine
- Molecular formula
- C7H11N5O2
- Molecular weight
- 197.19
Names & synonyms
4-(2H-tetraazol-5-ylacetyl)morpholine1-morpholin-4-yl-2-(5H-tetrazol-5-yl)ethanoneAN-666/37293009Ethanone, 1-(4-morpholinyl)-2-(5H-tetrazol-5-yl)-
Database identifiers
- CAS
877055-27-1
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 79 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 259
Physicochemical properties
- Boiling point
- 361.7 · 361.7±52.0 °C(Predicted)
- Density
- 1.62 · 1.62±0.1 g/cm3(Predicted)
- pka
- -1.04 · -1.04±0.20(Predicted)
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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