Basic information
- CAS
17429-05-9- Standard SMILES
COCCCC(=O)C(C)C- InChIKey
DKSVJNVVHZQCEX-UHFFFAOYSA-N- Molecular formula
- C8H16O2
- Average molar mass
- 144.21 g/mol
- Monoisotopic mass
- 144.11502975
Names & identifiers
- Preferred name
- 6-Methoxy-2-methyl-3-hexanone
- IUPAC
- 6-methoxy-2-methylhexan-3-one
- English name
- 6-Methoxy-2-methyl-3-hexanone
- Molecular weight
- 0
Names & synonyms
6-methoxy-2-methylhexan-3-one6-METHOXY-2-METHYL-3-HEXANONE17429-05-93-Hexanone, 6-methoxy-2-methyl-SCHEMBL10085317DTXSID60169809DKSVJNVVHZQCEX-UHFFFAOYSA-N6-Methoxy-2-methyl-3-hexanone #
Database identifiers
- CAS
17429-05-9- PubChem CID
- 28541
- DTXSID
DTXSID60169809- Nikkaji
- J101.338F
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 97.4
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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