3-Fluorobenzotrifluoride - CAS 401-80-9

Catalog:	BB024353
Product Name:	3-Fluorobenzotrifluoride
CAS:	401-80-9
Synonyms:	Benzene, 1-fluoro-3-(trifluoromethyl)-; Toluene, m,α,α,α-tetrafluoro-; 3-Fluoro(trifluoromethyl)benzene; 3-Fluorobenzotrifluoride; m,α,α,α-Tetrafluorotoluene; m-(Trifluoromethyl)fluorobenzene; m-Fluoro(trifluoromethyl)benzene; m-Fluorobenzotrifluoride; NSC 10315; Trifluoromethyl-3-fluorobenzene; α,α,α,3-Tetrafluorotoluene

3-Fluorobenzotrifluoride

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Computed Properties

IUPAC Name:	1-fluoro-3-(trifluoromethyl)benzene
Description:	3-Fluorobenzotrifluoride (CAS# 401-80-9) is a fluorniated toluene used in photochemical reactions with aliphatic amines as well as in photocycloaddition reactions.
Molecular Weight:	164.10
Molecular Formula:	C7H4F4
Canonical SMILES:	C1=CC(=CC(=C1)F)C(F)(F)F
InChI:	InChI=1S/C7H4F4/c8-6-3-1-2-5(4-6)7(9,10)11/h1-4H
InChI Key:	GBOWGKOVMBDPJF-UHFFFAOYSA-N
Boiling Point:	101.5°C
Melting Point:	-81.5°C
Purity:	≥95%
Density:	1.2891 g/cm3
Solubility:	Soluble in Chloroform
Appearance:	Clear Colorless to Light Yellow Liquid
Storage:	Store at 2-8°C
MDL:	MFCD00000382
LogP:	2.84450

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