P-FLUOROTOLUENE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H7F
Molecular Weight	110.1289
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of P-FLUOROTOLUENE

SMILES

CC1=CC=C(F)C=C1

InChI

InChIKey=WRWPPGUCZBJXKX-UHFFFAOYSA-N

InChI=1S/C7H7F/c1-6-2-4-7(8)5-3-6/h2-5H,1H3

HIDE SMILES / InChI

Molecular Formula	C7H7F
Molecular Weight	110.1289
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
Syntheses and biological evaluation of indole-2 and 3-carboxamides: new selective cyclooxygenase-2 inhibitors.	2002 Apr	11998441
Pressure and temperature dependence of the recombination of p-fluorobenzyl radicals.	2006 Mar 2	16494370
New potent indole derivatives as hyaluronidase inhibitors.	2007 Dec	17986205
Photodissociation dynamics of small aromatic molecules studied by multimass ion imaging.	2007 Nov 8	17935318
Influence of the electronics of the phosphine ligands on the H-H bond elongation in dihydrogen complexes.	2008 Jan 21	18081272

Showing 1 to 5 of 5 entries

Patents

Substance Class	Chemical
Record UNII	NUD6WZ1B8F
Record Status	`Validated (UNII)`
Record Version

Show entries

Name

Type

Language

NSC-8861

Preferred Name

English

P-FLUOROTOLUENE

Common Name

English

P-FLUOROMETHYLBENZENE

Common Name

English

4-FLUOROTOLUENE

Systematic Name

English

1-FLUORO-4-METHYLBENZENE

Systematic Name

English

Showing 1 to 5 of 11 entries

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Show entries

Code System

Code

Type

Description

NSC

8861

PRIMARY

PUBCHEM

9603

PRIMARY

EPA CompTox

DTXSID7059852

PRIMARY

MERCK INDEX

m5482

PRIMARY

Merck Index

FDA UNII

NUD6WZ1B8F

PRIMARY

Showing 1 to 5 of 7 entries

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