Fluorobenzene 99% For Synthesis

CAT: 1507-01238 00500Size: 500 mLDry Ice: NoHazardous: No

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CAT#:1507-01238 00500Size:500 mL

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CAS Number

462-06-6

Chemical Information

Fluorobenzene

Monofluorobenzene is the simplest member of the class of monofluorobenzenes that is benzene carrying a single fluoro substituent.

CAS Number	462-06-6
PubChem CID	10008
IUPAC Name	fluorobenzene
Molecular Formula	C6H5F
Molecular Weight	96.10
XLogP	2.3
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	7
Formal Charge	0
Complexity	46

SMILES

C1=CC=C(C=C1)F

InChI

InChI=1S/C6H5F/c7-6-4-2-1-3-5-6/h1-5H

InChIKey

PYLWMHQQBFSUBP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 462-06-6

CID: 10008

Formula: C6H5F

MW: 96.10

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	96.10
XLogP3	2.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	96.037528322
Monoisotopic Mass	96.037528322
Topological Polar Surface Area	0 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	46.1
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Catalog	Name
01238 02500	Fluorobenzene 99% For Synthesis
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