1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene

C11H10F4 — CID 168782513

IUPAC1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene
SMILESC=Cc1c(F)c(F)c(CCC)c(F)c1F
InChIInChI=1S/C11H10F4/c1-3-5-7-10(14)8(12)6(4-2)9(13)11(7)15/h4H,2-3,5H2,1H3
InChIKeyNPAYBMSUQUKFPS-UHFFFAOYSA-N
MW218.19 g/mol
LogP3.84
Rot. Bonds3

About 1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene

1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene (PubChem CID 168782513) has the molecular formula C11H10F4 and a molecular weight of 218.19 g/mol. Its IUPAC name is 1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene.

Molecular Properties

Compound Name1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene
PubChem CID168782513
Molecular FormulaC11H10F4
Molecular Weight218.19 g/mol
Exact Mass218.07
IUPAC Name1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene
SMILESC=Cc1c(F)c(F)c(CCC)c(F)c1F
InChIInChI=1S/C11H10F4/c1-3-5-7-10(14)8(12)6(4-2)9(13)11(7)15/h4H,2-3,5H2,1H3
InChIKeyNPAYBMSUQUKFPS-UHFFFAOYSA-N
XLogP3.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.19
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(2,3,5,6-tetrafluoro-4-propylphenyl)phosphane
CID 166866100
4-ethenyl-2,3,5,6-tetrafluorobenzaldehyde
CID 163463323
1,2-bis(ethenyl)-3,4,5,6-tetrafluorobenzene
CID 19989308
1,2,4,5-tetrafluoro-3-propylbenzene
CID 12944004
1-(2,3,5,6-tetrafluoro-4-propylphenyl)ethanone
CID 165347604
1-ethenyl-2,3,5,6-tetrafluoro-4-methoxybenzene
CID 71669119
1-ethenyl-3-fluoro-2-propylbenzene
CID 66613054
1,2,3,5-tetrafluoro-4-propylbenzene
CID 88575988
CID 165046021
CID 165046021
1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane
CID 160860581
sodium tetrakis(4-ethenyl-2,3,5,6-tetrafluorophenyl)boranuide
CID 142744683
5-[2-(2,3,4,5,6-pentafluorophenyl)ethenyl]-2-propylbenzene-1,3-diol
CID 74380181

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene?
The IUPAC name of 1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene (CID 168782513) is 1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene.
What is the SMILES notation for 1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene?
The canonical SMILES for 1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene is C=Cc1c(F)c(F)c(CCC)c(F)c1F.
What is the InChIKey of 1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene?
The InChIKey is NPAYBMSUQUKFPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F4/c1-3-5-7-10(14)8(12)6(4-2)9(13)11(7)15/h4H,2-3,5H2,1H3.
What are the key properties of 1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene?
1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene has a molecular weight of 218.19 g/mol, XLogP of 3.84, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-2,3,5,6-tetrafluoro-4-propylbenzene is sourced from PubChem (CID 168782513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).