1,3,5-trifluorobenzene

C6H3F3 — CID 9745

IUPAC1,3,5-trifluorobenzene
SMILESFc1cc(F)cc(F)c1
InChIInChI=1S/C6H3F3/c7-4-1-5(8)3-6(9)2-4/h1-3H
InChIKeyJXUKFFRPLNTYIV-UHFFFAOYSA-N
MW132.08 g/mol
LogP2.10
Rot. Bonds

About 1,3,5-trifluorobenzene

1,3,5-trifluorobenzene (PubChem CID 9745) has the molecular formula C6H3F3 and a molecular weight of 132.08 g/mol. Its IUPAC name is 1,3,5-trifluorobenzene.

Molecular Properties

Compound Name1,3,5-trifluorobenzene
PubChem CID9745
Molecular FormulaC6H3F3
Molecular Weight132.08 g/mol
Exact Mass132.02
IUPAC Name1,3,5-trifluorobenzene
SMILESFc1cc(F)cc(F)c1
InChIInChI=1S/C6H3F3/c7-4-1-5(8)3-6(9)2-4/h1-3H
InChIKeyJXUKFFRPLNTYIV-UHFFFAOYSA-N
XLogP2.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.08
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Benzene
CID 241
Fluorobenzene
CID 10008
1,3-Difluorobenzene
CID 9741
Benzene-D6
CID 71601
Pentafluorobenzene
CID 9696
1,4-Difluorobenzene
CID 10892
Phenyllithium
CID 53629015
4-Fluoroiodobenzene
CID 9605
1-Fluoro-3-iodobenzene
CID 70725
(3,5-Difluorophenyl)boronic acid
CID 2734338
1,2-Difluorobenzene
CID 9706
Potassium (2,6-difluorophenyl)trifluoroboranuide
CID 23677741

Frequently Asked Questions

What is the IUPAC name of 1,3,5-trifluorobenzene?
The IUPAC name of 1,3,5-trifluorobenzene (CID 9745) is 1,3,5-trifluorobenzene.
What is the SMILES notation for 1,3,5-trifluorobenzene?
The canonical SMILES for 1,3,5-trifluorobenzene is Fc1cc(F)cc(F)c1.
What is the InChIKey of 1,3,5-trifluorobenzene?
The InChIKey is JXUKFFRPLNTYIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3F3/c7-4-1-5(8)3-6(9)2-4/h1-3H.
What are the key properties of 1,3,5-trifluorobenzene?
1,3,5-trifluorobenzene has a molecular weight of 132.08 g/mol, XLogP of 2.10, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,5-trifluorobenzene is sourced from PubChem (CID 9745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).