1-ethenyl-3,5-bis(trifluoromethyl)benzene

C10H6F6 — CID 2773242

IUPAC1-ethenyl-3,5-bis(trifluoromethyl)benzene
SMILESC=Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1
InChIInChI=1S/C10H6F6/c1-2-6-3-7(9(11,12)13)5-8(4-6)10(14,15)16/h2-5H,1H2
InChIKeyLFICVUCVPKKPFF-UHFFFAOYSA-N
MW240.15 g/mol
LogP4.37
Rot. Bonds1

About 1-ethenyl-3,5-bis(trifluoromethyl)benzene

1-ethenyl-3,5-bis(trifluoromethyl)benzene (PubChem CID 2773242) has the molecular formula C10H6F6 and a molecular weight of 240.15 g/mol. Its IUPAC name is 1-ethenyl-3,5-bis(trifluoromethyl)benzene.

Molecular Properties

Compound Name1-ethenyl-3,5-bis(trifluoromethyl)benzene
PubChem CID2773242
Molecular FormulaC10H6F6
Molecular Weight240.15 g/mol
Exact Mass240.04
IUPAC Name1-ethenyl-3,5-bis(trifluoromethyl)benzene
SMILESC=Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1
InChIInChI=1S/C10H6F6/c1-2-6-3-7(9(11,12)13)5-8(4-6)10(14,15)16/h2-5H,1H2
InChIKeyLFICVUCVPKKPFF-UHFFFAOYSA-N
XLogP4.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.15
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-3,5-bis(trifluoromethyl)benzene?
The IUPAC name of 1-ethenyl-3,5-bis(trifluoromethyl)benzene (CID 2773242) is 1-ethenyl-3,5-bis(trifluoromethyl)benzene.
What is the SMILES notation for 1-ethenyl-3,5-bis(trifluoromethyl)benzene?
The canonical SMILES for 1-ethenyl-3,5-bis(trifluoromethyl)benzene is C=Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1.
What is the InChIKey of 1-ethenyl-3,5-bis(trifluoromethyl)benzene?
The InChIKey is LFICVUCVPKKPFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F6/c1-2-6-3-7(9(11,12)13)5-8(4-6)10(14,15)16/h2-5H,1H2.
What are the key properties of 1-ethenyl-3,5-bis(trifluoromethyl)benzene?
1-ethenyl-3,5-bis(trifluoromethyl)benzene has a molecular weight of 240.15 g/mol, XLogP of 4.37, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-3,5-bis(trifluoromethyl)benzene is sourced from PubChem (CID 2773242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).