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Sigma-Aldrich

1-Fluorododecane

98%

Synonym(s):

n-Dodecyl fluoride

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About This Item

Linear Formula:
F(CH2)11CH3
CAS Number:
334-68-9
Molecular Weight:
188.33
EC Number:
206-381-1
MDL number:
MFCD00013580
UNSPSC Code:
12352100
PubChem Substance ID:
24878349
NACRES:
NA.22

Assay

98%

refractive index

n20/D 1.42 (lit.)

density

0.807 g/mL at 25 °C (lit.)

SMILES string

CCCCCCCCCCCCF

InChI

1S/C12H25F/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-12H2,1H3

InChI key

YHYBNVZCQIDLSQ-UHFFFAOYSA-N

General description

1-Fluorododecane is a long chain 1-fluoroalkane. It can be synthesized from the reaction between 1-dodecanol, N,N-diethyl-α,α-difluoro-[3,5-bis(1H,1H,2H,2H-perfluorodecyl)benzyl]amine and heptane. 1-Fluorododecane undergoes reaction with dibromomethane and titanocene dichloride in the presence of triethyl aluminium (Et3Al) to afford a mixture of 1-chlorododecane and 1-bromododecane. 1-Fluorododecane can also be prepared from 1-hydroxydodecane.

Pictograms

Skull and crossbones
GHS06

Signal Word

Danger

Hazard Statements

H300,H413

Precautionary Statements

P273 - P301 + P310 + P330

Hazard Classifications

Acute Tox. 2 Oral - Aquatic Chronic 4

Storage Class Code

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

WGK

WGK 3

Flash Point(F)

223.0 °F - closed cup

Flash Point(C)

106.1 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Fluorination of alcohols and diols with a novel fluorous deoxy-fluorination reagent.
Furuya T, et al.
Journal of Fluorine Chemistry, 130(2), 348-353 (2009)
Vapor Pressures and Boiling Points of the 1-Fluoroalkanes, 1-Chloroalkanes, 1-Bromoalkanes, and 1-Iodoalkanes, C1to C20.
Li JCM and Rossini RD.
Journal of Chemical and Engineering Data, 6(2), 268-270 (1961)
Halogen Exchange Reaction of Aliphatic Fluorine Compounds with Organic Halides as Halogen Source.
Mizukami Y, et al.
Organic Letters, 17(24), 5942-5945 (2015)
Regioselective Hydroxylation of C12?C15 Fatty Acids with Fluorinated Substituents by Cytochrome P450 BM3.
Chiang, Chih-Hsiang, et al.
Chemistry?A European Journal , 19(41), 13680-13691 (2013)

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