Basic information
- CAS
5344-30-9- Standard SMILES
C=C(C)CCCC(C)C(O)C=O- InChIKey
GHEHLAKTQJFKHN-UHFFFAOYSA-N- Molecular formula
- C10H18O2
- Average molar mass
- 170.25 g/mol
- Monoisotopic mass
- 170.13067981
Names & identifiers
- Preferred name
- 2-Hydroxy-3,7-dimethyloct-7-enal
- IUPAC
- 2-hydroxy-3,7-dimethyloct-7-enal
Names & synonyms
2-hydroxy-3,7-dimethyloct-7-enal5344-30-9NSC-1099NSC1099WC2UA7N3CNDTXSID202771962-Hydroxy-3,7-dimethyl-7-octenal7-Octenal, 2-hydroxy-3,7-dimethyl-
Database identifiers
- CAS
5344-30-9- PubChem CID
- 219610
- DTXSID
DTXSID20277196- UNII
- WC2UA7N3CN
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 152
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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