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250082

1-Fluoroheptane

98%

Synonym(s):

Heptyl fluoride

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About This Item

Linear Formula:
CH3(CH2)6F
CAS Number:
661-11-0
Molecular Weight:
118.19
NACRES:
NA.22
PubChem Substance ID:
24855033
UNSPSC Code:
12352100
EC Number:
211-545-0
MDL number:
MFCD00013581
Assay:
98%
Form:
liquid
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Quality Segment

assay

98%

form

liquid

refractive index

n20/D 1.386 (lit.)

bp

119.2 °C/750 mmHg (lit.)

density

0.806 g/mL at 25 °C (lit.)

functional group

alkyl halide, fluoro

SMILES string

CCCCCCCF

InChI

1S/C7H15F/c1-2-3-4-5-6-7-8/h2-7H2,1H3

InChI key

BITLXSQYFZTQGC-UHFFFAOYSA-N

General description

Specific rotations of chiral conformers of 1-fluoroheptane were computed using an approach in which localization is enforced throughout the orbital optimization and subsequent linear response computation.

Pictograms

FlameExclamation mark
GHS02,GHS07

Signal Word

Danger

Hazard Classifications

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

Target Organs

Respiratory system

Storage Class

3 - Flammable liquids

WGK

WGK 3

Flash Point (°F)

57.2 °F - closed cup

Flash Point (°C)

14 °C - closed cup

PPE (personal protective equipment)

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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