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Sigma-Aldrich

1-Fluorooctane

98%

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Synonym(s):
Octyl fluoride
Linear Formula:
CH3(CH2)7F
CAS Number:
463-11-6
Molecular Weight:
132.22
EC Number:
207-333-2
MDL number:
MFCD00013582
PubChem Substance ID:
24855034
NACRES:
NA.22

Quality Level

100

Assay

98%

form

liquid

refractive index

n20/D 1.396 (lit.)

bp

142-146 °C (lit.)

density

0.814 g/mL at 25 °C (lit.)

SMILES string

CCCCCCCCF

InChI

1S/C8H17F/c1-2-3-4-5-6-7-8-9/h2-8H2,1H3

InChI key

DHIVLKMGKIZOHF-UHFFFAOYSA-N

Related Categories

General description

1-Fluorooctane undergoes C-F bond-cleavage reaction with phenyl magnesium chloride to give n-octylbenzene. It reacts rapidly with trimethylsilyl iodide to give corresponding octyl iodides and trimethylsilyl fluoride.

Application

1-Fluorooctane has been used as a molecular probe in evaluations of gas chromatographic stationary phases consisting of bromo- and chloro-derivatives of a C78 branched alkane.

Pictograms

FlameExclamation mark
GHS02,GHS07

Signal Word

Warning

Hazard Statements

H226 - H315 - H319 - H335

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

3 - Flammable liquids

WGK

WGK 3

Flash Point(F)

107.6 °F - closed cup

Flash Point(C)

42 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

危险化学品

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Ervin Sz Kováts et al.
Journal of chromatography. A, 1113(1-2), 206-219 (2006-02-25)
In a paper published in 1992 [K.S. Reddy, J.-Cl. Dutoit, E.sz. Kováts, Pair-wise interactions by gas chromatography. I. Interaction free enthalpies of solutes with non-associated primary alcohol groups, J. Chromatogr. 609 (1992) 229] retention indices and standard chemical potential differences
Kouki Matsubara et al.
Organic letters, 11(8), 1765-1768 (2009-03-14)
An unexpected C-F bond-cleavage reaction of unactivated fluoroalkanes with the well-known Grignard reagents without using metal catalysts has been discovered. For example, a reaction between 1-fluorooctane and phenyl magnesium chloride gave n-octylbenzene in moderate yield. This coupling reaction via the
Halogen redistribution reactions between alkyl halides and trimethylsilyl iodide.
Friedrich EC and De Lucca G.
Journal of Organometallic Chemistry, 226(2), 143-148 (1982)

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