Basic information
- CAS
21964-48-7- Standard SMILES
C=CCCCCCCCCCC=C- InChIKey
BPHFKBMQSYYNGQ-UHFFFAOYSA-N- Molecular formula
- C13H24
- Average molar mass
- 180.33 g/mol
- Monoisotopic mass
- 180.18780077
Overview
1,12-Tridecadiene is an alkadiene.
Names & identifiers
- Preferred name
- 1,12-Tridecadiene
- IUPAC
- trideca-1,12-diene
- English name
- 1,12-Tridecadiene
- Molecular formula
- C13H24
- Molecular weight
- 180.33
Names & synonyms
1,12-TRIDECADIENE21964-48-7tridecadiene-1,12DTXSID20176372RefChem:71198DTXCID8098863BPHFKBMQSYYNGQ-UHFFFAOYSA-Ntrideca-1,12-dieneSCHEMBL219063SCHEMBL7704112SCHEMBL11263505SCHEMBL16581545
Show more names
CHEBI:151033AKOS006325203NS00096186
Database identifiers
- CAS
21964-48-7- PubChem CID
- 30874
- DTXSID
DTXSID20176372- ChEBI
CHEBI:151033- Nikkaji
- J102.694A
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 10
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 99.2
Experimental & physicochemical properties
Chemical ClassesOther Classes -> Aliphatics, Unsaturated
SpringerMaterials PropertiesOptical coefficient
Physicochemical properties
- Boiling point
- 225.2 · 225.2±7.0 °C(Predicted)
- Density
- 0.772 · 0.772±0.06 g/cm3(Predicted)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Hazards SummarySee Tridecene.
Chemistry & industry
Additional notes
DefinitionChEBI: 1,12-Tridecadiene is an alkadiene.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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