Basic information
- CAS
40642-38-4- Standard SMILES
CCCCCCC=CCCCCO- InChIKey
OTJWLIMIKGBSSN-UHFFFAOYSA-N- Molecular formula
- C12H24O
- Average molar mass
- 184.32 g/mol
- Monoisotopic mass
- 184.18271539
Names & identifiers
- Preferred name
- 5-Dodecen-1-ol, (5E)-ol
- IUPAC
- dodec-5-en-1-ol
- English name
- (Z)-dodec-5-enol
- Molecular formula
- C12H24O
- Molecular weight
- 184.32
Names & synonyms
SCHEMBL1300999SCHEMBL72957355-Dodecen-1-ol, (5E)-ol(Z)-Dodec-5-en-1-oldodec-5-en-1-ol5Z-Dodecen-1-ol(Z)-dodec-5-enol)-5-Dodecen-1-ol(Z)-5-Dodecen-1-ol5-Dodecen-1-ol, (5Z)-
Database identifiers
- CAS
40642-38-4- PubChem CID
- 112970
- EC Number
- 255-018-3
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 9
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 108
Physicochemical properties
- Melting point
- 77.27 °C · 77.27°C (estimate)
- Boiling point
- 283.3 °C · 283.3°C (estimate)
- Density
- 0.8597 · 0.8597 (estimate)
- refractive index
- 1.4531 · 1.4531 (estimate)
- pka
- 15.15 · 15.15±0.10(Predicted)
- InChI
- InChI=1S/C12H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h7-8,13H,2-6,9-12H2,1H3/b8-7-
- InChIKey
- OTJWLIMIKGBSSN-FPLPWBNLSA-N
- SMILES
- C(O)CCC/C=C\CCCCCC
Chemistry & industry
Applications
Description(Z)-dodec-5-enol is an important unsaturated fatty alcohol, primarily identified as a component of pheromones or their synthetic precursors in various Lepidoptera insects. It can be used as a lure in traps to monitor pest population dynamics. It is also employed as an intermediate in the synthesis of complex diene-based attractants.
Uses(5Z)-5-Dodecen-1-ol is used as a reactant in stereoselective preparation of bacteriocin stereoisomers as antibacterial agents.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers15 total
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海有德化工科技有限公司021-37910092 15821801668 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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