PENTAFLUOROBENZENE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6HF5
Molecular Weight	168.0642
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PENTAFLUOROBENZENE

SMILES

FC1=CC(F)=C(F)C(F)=C1F

InChI

InChIKey=WACNXHCZHTVBJM-UHFFFAOYSA-N

InChI=1S/C6HF5/c7-2-1-3(8)5(10)6(11)4(2)9/h1H

HIDE SMILES / InChI

Molecular Formula	C6HF5
Molecular Weight	168.0642
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Show entries

Title	Date	PubMed
Quantitative (13)C NMR analysis of lignins with internal standards.	2001 Aug	11513630
Quantitative determination of intermolecular interactions with fluorinated aromatic rings.	2001 Aug 17	11560319
Troposelective substitutions in microsolvated systems.	2001 Jun 27	11414841
A laser flash photolysis and quantum chemical study of the fluorinated derivatives of singlet phenylnitrene.	2001 Mar 7	11456816
Using pentafluorophenyl as a Lewis acid to stabilize a cis secondary amide conformation.	2001 Nov 1	11678717

Showing 1 to 5 of 39 entries

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Patents

Substance Class	Chemical
Record UNII	IH36LU53XS
Record Status	`Validated (UNII)`
Record Version

Show entries

Name

Type

Language

PENTAFLUOROBENZENE

Systematic Name

English

BENZENE, 1,2,3,4,5-PENTAFLUORO-

Systematic Name

English

BENZENE, PENTAFLUORO-

Systematic Name

English

1,2,3,4,5-PENTAFLUOROBENZENE

Systematic Name

English

NSC-88293

Code

English

Showing 1 to 5 of 5 entries

Show entries

Code System

Code

Type

Description

PUBCHEM

9696

PRIMARY

ECHA (EC/EINECS)

206-658-7

PRIMARY

WIKIPEDIA

Pentafluorobenzene

PRIMARY

NSC

88293

PRIMARY

CAS

363-72-4

PRIMARY

Showing 1 to 5 of 7 entries

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