Basic information
- CAS
80625-30-5- Standard SMILES
C=CCCCCCC=CC=CCC- InChIKey
BUPYQWCKNDOIJS-UHFFFAOYSA-N- Molecular formula
- C13H22
- Average molar mass
- 178.31 g/mol
- Monoisotopic mass
- 178.1721507
Names & identifiers
- Preferred name
- (8E,10Z)-1,8,10-Tridecatriene
- IUPAC
- trideca-1,8,10-triene
- English name
- (8E,10Z)-1,8,10-Tridecatriene
- Molecular formula
- C13H22
- Molecular weight
- 178.31
Names & synonyms
trideca-1,8,10-triene(8E,10Z)-1,8,10-Tridecatriene80625-30-5SCHEMBL28731003DTXSID20338397NS000960091,8,10-Tridecatriene, (Z,E)- (9CI)
Database identifiers
- CAS
80625-30-5- PubChem CID
- 548898
- DTXSID
DTXSID20338397
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 8
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 151
Physicochemical properties
- Boiling point
- 240.882 · 240.882±10.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.791 · 0.791±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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