Basic information
- CAS
5579-73-7- Standard SMILES
CCCCC(=O)C(=O)CCCC- InChIKey
JWBLHPVQAOSXRF-UHFFFAOYSA-N- Molecular formula
- C10H18O2
- Average molar mass
- 170.25 g/mol
- Monoisotopic mass
- 170.13067981
Names & identifiers
- Preferred name
- 5,6-Decanedione
- IUPAC
- decane-5,6-dione
- English name
- 5,6-Decanedione
- Molecular formula
- C10H18O2
- Molecular weight
- 170.25
Names & synonyms
5,6-DecanedioneBivaleryl5579-73-7DTXSID4063953RefChem:101126DTXCID7041964JWBLHPVQAOSXRF-UHFFFAOYSA-Ndecane-5,6-dioneCHEMBL1812855SCHEMBL2846729BDBM50350320ecane-5,6-dione
Database identifiers
- CAS
5579-73-7- PubChem CID
- 79690
- DTXSID
DTXSID4063953- ChEMBL
CHEMBL1812855- Nikkaji
- J102.314D
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 132
Physicochemical properties
- Melting point
- 6.5 °C · 6.5 °C
- Boiling point
- 93 · 93-95 °C(Press: 18 Torr)
- Density
- 0.906 · 0.906±0.06 g/cm3(Predicted)
- EPA Substance Registry System
- 5 · 5,6-Decanedione (5579-73-7)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information5,6-Decanedione: INACTIVE
Suppliers2 total
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
北京融合创业科技有限公司+86-10-80447090 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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