Hexafluorobenzene - CAS 392-56-3

Catalog:	BB023917
Product Name:	Hexafluorobenzene
CAS:	392-56-3
Synonyms:	1,2,3,4,5,6-hexafluorobenzene

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	1,2,3,4,5,6-hexafluorobenzene
Description:	Hexafluorobenzene (CAS# 392-56-3) is a reagent in organic synthesis, such as the preparation of multifluorinated biaryls. Also used in the synthesis of semiconducting polymers as field transistors.
Molecular Weight:	186.05
Molecular Formula:	C6F6
Canonical SMILES:	C1(=C(C(=C(C(=C1F)F)F)F)F)F
InChI:	InChI=1S/C6F6/c7-1-2(8)4(10)6(12)5(11)3(1)9
InChI Key:	ZQBFAOFFOQMSGJ-UHFFFAOYSA-N
Boiling Point:	81-82 °C
Purity:	> 99.0 % (GC)
Density:	1.612 g/cm³
Appearance:	Liquid
MDL:	MFCD00000288
LogP:	2.52120
Vapor Pressure:	84.5 [mmHg]

Publication Number	Title	Priority Date
US-2015380122-A1	Electrically conductive thin films	20140627
WO-2015200200-A1	Cross metathesis approach to c11-c13 fatty-chain amino esters form oleic acid derivatives	20140623
EP-2955722-A1	Electrically conductive thin films	20140611
WO-2015181545-A1	Cyclising peptides	20140529
EP-2949778-A1	Electrically conductive thin films	20140527

PMID	Publication Date	Title	Journal
23107136	20121113	Halogen bonding: a new retention mechanism for the solid phase extraction of perfluorinated iodoalkanes	Analytica chimica acta
22990326	20121028	Pnicogen-π complexes: theoretical study and biological implications	Physical chemistry chemical physics : PCCP
22894352	20120807	Photophysics of fluorinated benzene. III. Hexafluorobenzene	The Journal of chemical physics
22581674	20120701	Liquid-liquid extraction for recovery of paclitaxel from plant cell culture: solvent evaluation and use of extractants for partitioning and selectivity	Biotechnology progress
23004267	20120615	Liquid-state nuclear spin comagnetometers	Physical review letters

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Related Functional Groups

Fluorinated Building Blocks

[1427357-61-6]
6-Fluoro-[1,2,4]triazolo[1,5-a]pyridine
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[1011396-69-2]
2,2-Difluoro-N-(4-methoxy-3-(methoxymethyl)benzyl)ethanamine
[452-76-6]
2,4-Difluorotoluene
[151585-93-2]
2-Amino-6-fluorobenzaldehyde
[459836-92-1]
3,6-Difluoro-2-methylbenzoic acid

Halides

[2367-82-0]
1,2,3,5-Tetrafluorobenzene
[1820736-42-2]
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
[932890-93-2]
1-{4-[(2,4-Dichlorobenzyl)oxy]-3-ethoxyphenyl}methanamine
[452-76-6]
2,4-Difluorotoluene
[73084-03-4]
2,4-di-tert-butyl-6-chloro-1,3,5-triazine
[856848-33-4]
2-Amino-4,5-dibromopyridine

Other Pyrimidines

[1183749-69-0]
2-(pyrimidin-2-yloxy)phenol
[150517-77-4]
3-Fluoro-5-(trifluoromethyl)benzylamine
[832739-73-8]
4-(3,5-Dichlorophenyl)pyrimidine-2-thiol
[551-62-2]
1,2,3,4-Tetrafluorobenzene
[1489-53-8]
1,2,3-Trifluorobenzene
[67490-21-5]
2,4,6-Tri-tert-butylpyrimidine

Complexity:	104
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	185.99041897
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	185.99041897
Rotatable Bond Count:	0
Topological Polar Surface Area:	0
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.5