Basic information
- CAS
114479-14-0- Standard SMILES
CC(=O)C#CN1CCOCC1- InChIKey
FVEXYNGPRZQHKP-UHFFFAOYSA-N- Molecular formula
- C8H11NO2
- Average molar mass
- 153.18 g/mol
Names & identifiers
- Preferred name
- 4-Morpholin-4-ylbut-3-yn-2-one
- IUPAC
- 4-morpholin-4-ylbut-3-yn-2-one
- English name
- 3-Butyn-2-one, 4-(4-morpholinyl)-
- Molecular formula
- C8H11NO2
- Molecular weight
- 153.18
Names & synonyms
4-morpholin-4-ylbut-3-yn-2-one114479-14-03-Butyn-2-one, 4-(4-morpholinyl)-3-Butyn-2-one, 4-(4-morpholinyl)-
Database identifiers
- CAS
114479-14-0- Nikkaji
- J2.780.519A
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 205
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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