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18202-10-3

18202-10-3 Structure

18202-10-3 Structure
IdentificationBack Directory
[Name]

11-DODECYN-1-OL
[CAS]

18202-10-3
[Synonyms]

11-dodecyn-1-01
11-DODECYN-1-OL
Dodec-11-yn-1-ol
[Molecular Formula]

C12H22O
[MDL Number]

MFCD07780248
[MOL File]

18202-10-3.mol
[Molecular Weight]

182.3
Chemical PropertiesBack Directory
[Melting point ]

18.8°C (estimate)
[Boiling point ]

285.73°C (rough estimate)
[density ]

0.8530 (estimate)
[refractive index ]

1.4535 (estimate)
[storage temp. ]

Sealed in dry,2-8°C
[form ]

<26°C Solid,>28°C Liquid
[pka]

15.20±0.10(Predicted)
[color ]

Colorless to off-white
[InChI]

InChI=1S/C12H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h1,13H,3-12H2
[InChIKey]

XNRAUTMOUDUPET-UHFFFAOYSA-N
[SMILES]

C(O)CCCCCCCCCC#C
Hazard InformationBack Directory
[Uses]

11-Dodecyn-1-ol is a synthetic intermediate of the sex pheromone (Z,E)-11,13,15-Hexadecatrienyl acetate for Thaumetopoea processionea[1].
[Synthesis]

NaH (7.5 g, 60% oil dispersion, 326 mmol) was added batchwise to a stirred 0 °C solution of dodeca-3-yn-1-ol (10.0 g, 54.95 mmol; GF Smith) in ethylenediamine (40 mL).After 1 h, the temperature was raised to 70 °C. The reaction mixture was cooled to 0 °C
[References]

[1] Gries R, et al. (Z, Z)-11, 13-Hexadecadienyl acetate and (Z, E)-11, 13, 15-hexadecatrienyl acetate: synergistic sex pheromone components of oak processionary moth, Thaumetopoea processionea (Lepidoptera: Thaumetopoeidae)[J]. Chemoecology, 2004, 14: 95-100...
Spectrum DetailBack Directory
[Spectrum Detail]

11-DODECYN-1-OL(18202-10-3)1HNMR
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