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About This Item
Empirical Formula (Hill Notation):
C6H3ClF6O
CAS Number:
Molecular Weight:
240.53
UNSPSC Code:
12352100
PubChem Substance ID:
MDL number:
InChI
1S/C6H3ClF6O/c1-14-3-2(7)4(8,9)6(12,13)5(3,10)11/h1H3
SMILES string
COC1=C(Cl)C(F)(F)C(F)(F)C1(F)F
InChI key
QLPINEFCFXPUSF-UHFFFAOYSA-N
assay
97%
refractive index
n20/D 1.376 (lit.)
bp
84 °C (lit.)
density
1.56 g/mL at 25 °C (lit.)
Application
Used in the preparation of perhalocyclopentanones and more recently to prepare tetracarbocyanine dyes with fluorinated rings in the side chain.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
120.2 °F - closed cup
flash_point_c
49 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
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The Journal of Organic Chemistry, 33, 2692-2692 (1968)
Zh. Org. Khim., 28, 1508-1508 (1992)
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