Basic information
- CAS
88357-34-0- Standard SMILES
O=CC#CC#CN1CCOCC1- InChIKey
GGFLUTMTAUMRMQ-UHFFFAOYSA-N- Molecular formula
- C9H9NO2
- Average molar mass
- 163.17 g/mol
- Monoisotopic mass
- 163.06332853
Names & identifiers
- Preferred name
- 5-Morpholin-4-ylpenta-2,4-diynal
- IUPAC
- 5-morpholin-4-ylpenta-2,4-diynal
Names & synonyms
5-morpholin-4-ylpenta-2,4-diynal2,4-pentadiynal, 5-(4-morpholinyl)-88357-34-0DTXSID70348724RefChem:304340DTXCID60299796InChI=1/C9H9NO2/c11-7-3-1-2-4-10-5-8-12-9-6-10/h7H,5-6,8-9H5-(MORPHOLIN-4-YL)PENTA-2,4-DIYNAL
Database identifiers
- CAS
88357-34-0- PubChem CID
- 640360
- DTXSID
DTXSID70348724
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 277
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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