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871-91-0

871-91-0 Structure

871-91-0 Structure
IdentificationBack Directory
[Name]

7-OCTYN-1-OL
[CAS]

871-91-0
[Synonyms]

7-OCTYN-1-OL
oct-7-yn-1-ol
7-Octyn-1-ol>
Octane-7-yne-1-ol
8-Hydroxy-1-octyne
7-OCTYN-1-OL, 97%7-OCTYN-1-OL, 97%7-OCTYN-1-OL, 97%
[Molecular Formula]

C8H14O
[MDL Number]

MFCD01632137
[MOL File]

871-91-0.mol
[Molecular Weight]

126.2
Chemical PropertiesBack Directory
[Melting point ]

-39°C (estimate)
[Boiling point ]

110-112°C 15mm
[density ]

0.889
[refractive index ]

1.4520 to 1.4560
[Fp ]

116℃
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Oil
[pka]

15.17±0.10(Predicted)
[color ]

Colourless
[λmax]

226nm(CH3CN)(lit.)
[InChI]

InChI=1S/C8H14O/c1-2-3-4-5-6-7-8-9/h1,9H,3-8H2
[InChIKey]

ATCNYMVVGBLQMQ-UHFFFAOYSA-N
[SMILES]

C(O)CCCCCC#C
[EPA Substance Registry System]

7-Octyn-1-ol (871-91-0)
Safety DataBack Directory
[Risk Statements ]

10
[Safety Statements ]

16
[RIDADR ]

1987
[WGK Germany ]

3
[TSCA ]

TSCA listed
[HS Code ]

2905299090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
Hazard InformationBack Directory
[Uses]

7-Octyn-1-ol is used in the synthesis of the sex pheromone of the citrus leafminer, Phyllocnistis citrella.
[Synthesis Reference(s)]

Synthetic Communications, 20, p. 2733, 1990 DOI: 10.1080/00397919008051482
Tetrahedron Letters, 28, p. 2409, 1987 DOI: 10.1016/S0040-4039(00)96138-0
Spectrum DetailBack Directory
[Spectrum Detail]

7-OCTYN-1-OL(871-91-0)1HNMR
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