1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene

C14H7F5 — CID 102498267

IUPAC1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene
SMILESC=Cc1ccc(-c2c(F)c(F)c(F)c(F)c2F)cc1
InChIInChI=1S/C14H7F5/c1-2-7-3-5-8(6-4-7)9-10(15)12(17)14(19)13(18)11(9)16/h2-6H,1H2
InChIKeyOVKVXKNNRUUEIG-UHFFFAOYSA-N
MW270.20 g/mol
LogP4.69
Rot. Bonds2

About 1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene

1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene (PubChem CID 102498267) has the molecular formula C14H7F5 and a molecular weight of 270.20 g/mol. Its IUPAC name is 1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene.

Molecular Properties

Compound Name1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene
PubChem CID102498267
Molecular FormulaC14H7F5
Molecular Weight270.20 g/mol
Exact Mass270.05
IUPAC Name1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene
SMILESC=Cc1ccc(-c2c(F)c(F)c(F)c(F)c2F)cc1
InChIInChI=1S/C14H7F5/c1-2-7-3-5-8(6-4-7)9-10(15)12(17)14(19)13(18)11(9)16/h2-6H,1H2
InChIKeyOVKVXKNNRUUEIG-UHFFFAOYSA-N
XLogP4.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.20
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

1-[4-(4-ethenylphenyl)phenyl]-2,3,4,5,6-pentakis-phenylbenzene
CID 100913685
(NE)-N-[[4-(2,3,4,5,6-pentafluorophenyl)phenyl]methylidene]hydroxylamine
CID 11044378
1,2,3-tris(4-ethenylphenyl)benzene
CID 154053101
4-[4-(4-ethenylphenyl)phenyl]-1,2-difluorobenzene
CID 171595464
1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene
CID 123748481
ethane;1-ethenyl-4-fluorobenzene
CID 143529924
1,2,3,4,5-pentafluoro-6-[4-(4-phenylphenyl)phenyl]benzene
CID 102031632
1-(4-ethenylphenyl)-2,4,5-trifluorobenzene
CID 44623494
1-ethenyl-4-methylbenzene;methane
CID 142136023
CID 174976037
CID 174976037
1-ethenyl-4-fluorobenzene;toluene
CID 170790144
1-ethenyl-4-(1,1,2,2,2-pentafluoroethyl)benzene
CID 18928984

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene?
The IUPAC name of 1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene (CID 102498267) is 1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene.
What is the SMILES notation for 1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene?
The canonical SMILES for 1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene is C=Cc1ccc(-c2c(F)c(F)c(F)c(F)c2F)cc1.
What is the InChIKey of 1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene?
The InChIKey is OVKVXKNNRUUEIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H7F5/c1-2-7-3-5-8(6-4-7)9-10(15)12(17)14(19)13(18)11(9)16/h2-6H,1H2.
What are the key properties of 1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene?
1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene has a molecular weight of 270.20 g/mol, XLogP of 4.69, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethenylphenyl)-2,3,4,5,6-pentafluorobenzene is sourced from PubChem (CID 102498267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).