1,2,3,4,5-pentakis(fluoromethyl)benzene

C11H11F5 — CID 57246019

IUPAC1,2,3,4,5-pentakis(fluoromethyl)benzene
SMILESFCc1cc(CF)c(CF)c(CF)c1CF
InChIInChI=1S/C11H11F5/c12-2-7-1-8(3-13)10(5-15)11(6-16)9(7)4-14/h1H,2-6H2
InChIKeyQMLCXOGQFWEHPS-UHFFFAOYSA-N
MW238.20 g/mol
LogP4.03
Rot. Bonds5

About 1,2,3,4,5-pentakis(fluoromethyl)benzene

1,2,3,4,5-pentakis(fluoromethyl)benzene (PubChem CID 57246019) has the molecular formula C11H11F5 and a molecular weight of 238.20 g/mol. Its IUPAC name is 1,2,3,4,5-pentakis(fluoromethyl)benzene.

Molecular Properties

Compound Name1,2,3,4,5-pentakis(fluoromethyl)benzene
PubChem CID57246019
Molecular FormulaC11H11F5
Molecular Weight238.20 g/mol
Exact Mass238.08
IUPAC Name1,2,3,4,5-pentakis(fluoromethyl)benzene
SMILESFCc1cc(CF)c(CF)c(CF)c1CF
InChIInChI=1S/C11H11F5/c12-2-7-1-8(3-13)10(5-15)11(6-16)9(7)4-14/h1H,2-6H2
InChIKeyQMLCXOGQFWEHPS-UHFFFAOYSA-N
XLogP4.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.20
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5-pentakis(fluoromethyl)benzene?
The IUPAC name of 1,2,3,4,5-pentakis(fluoromethyl)benzene (CID 57246019) is 1,2,3,4,5-pentakis(fluoromethyl)benzene.
What is the SMILES notation for 1,2,3,4,5-pentakis(fluoromethyl)benzene?
The canonical SMILES for 1,2,3,4,5-pentakis(fluoromethyl)benzene is FCc1cc(CF)c(CF)c(CF)c1CF.
What is the InChIKey of 1,2,3,4,5-pentakis(fluoromethyl)benzene?
The InChIKey is QMLCXOGQFWEHPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F5/c12-2-7-1-8(3-13)10(5-15)11(6-16)9(7)4-14/h1H,2-6H2.
What are the key properties of 1,2,3,4,5-pentakis(fluoromethyl)benzene?
1,2,3,4,5-pentakis(fluoromethyl)benzene has a molecular weight of 238.20 g/mol, XLogP of 4.03, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5-pentakis(fluoromethyl)benzene is sourced from PubChem (CID 57246019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).