[(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene

C11H10F4O — CID 173305402

IUPAC[(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene
SMILESFC(F)C(F)(F)CO/C=C/c1ccccc1
InChIInChI=1S/C11H10F4O/c12-10(13)11(14,15)8-16-7-6-9-4-2-1-3-5-9/h1-7,10H,8H2/b7-6+
InChIKeyBKHJWWSMTOWVAE-VOTSOKGWSA-N
MW234.19 g/mol
LogP3.57
Rot. Bonds5

About [(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene

[(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene (PubChem CID 173305402) has the molecular formula C11H10F4O and a molecular weight of 234.19 g/mol. Its IUPAC name is [(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene.

Molecular Properties

Compound Name[(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene
PubChem CID173305402
Molecular FormulaC11H10F4O
Molecular Weight234.19 g/mol
Exact Mass234.07
IUPAC Name[(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene
SMILESFC(F)C(F)(F)CO/C=C/c1ccccc1
InChIInChI=1S/C11H10F4O/c12-10(13)11(14,15)8-16-7-6-9-4-2-1-3-5-9/h1-7,10H,8H2/b7-6+
InChIKeyBKHJWWSMTOWVAE-VOTSOKGWSA-N
XLogP3.57
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.19
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

2-(chloromethoxy)ethenylbenzene
CID 54484183
bis(2,2,3,3-tetrafluoropropoxy)methylbenzene
CID 12839498
2-(2-chloroethoxy)ethenylbenzene
CID 54340888
triphenyl-bis(2,2,3,3-tetrafluoropropoxy)-λ5-phosphane
CID 10459459
2-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,11,11,11-icosafluoroundecoxy)ethenylbenzene
CID 151926824
1,4-bis(2,2,3,3-tetrafluoropropoxy)naphthalene-2,3-dicarbonitrile
CID 170305306
[(E)-2-(2-methylsulfanylethoxy)ethenyl]benzene
CID 10821658
2-phenylethenyl hypochlorite
CID 174846966
2-[(Z)-hex-3-enoxy]ethenylbenzene
CID 155674734
[(1Z,3E)-4-phenylbuta-1,3-dienyl] trifluoromethanesulfonate
CID 125475043
[diphenyl(2-phenylethenoxy)methyl]benzene
CID 54172131
[(1E,3Z)-4-phenoxybuta-1,3-dienyl]benzene
CID 13355038

Frequently Asked Questions

What is the IUPAC name of [(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene?
The IUPAC name of [(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene (CID 173305402) is [(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene.
What is the SMILES notation for [(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene?
The canonical SMILES for [(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene is FC(F)C(F)(F)CO/C=C/c1ccccc1.
What is the InChIKey of [(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene?
The InChIKey is BKHJWWSMTOWVAE-VOTSOKGWSA-N. The full InChI is InChI=1S/C11H10F4O/c12-10(13)11(14,15)8-16-7-6-9-4-2-1-3-5-9/h1-7,10H,8H2/b7-6+.
What are the key properties of [(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene?
[(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene has a molecular weight of 234.19 g/mol, XLogP of 3.57, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-2-(2,2,3,3-tetrafluoropropoxy)ethenyl]benzene is sourced from PubChem (CID 173305402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).