2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene

C11H10F4 — CID 90783714

IUPAC2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene
SMILESCC=C(F)F.FC(F)=Cc1ccccc1
InChIInChI=1S/C8H6F2.C3H4F2/c9-8(10)6-7-4-2-1-3-5-7;1-2-3(4)5/h1-6H;2H,1H3
InChIKeyCRPPTZNQOHIZLN-UHFFFAOYSA-N
MW218.19 g/mol
LogP4.71
Rot. Bonds1

About 2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene

2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene (PubChem CID 90783714) has the molecular formula C11H10F4 and a molecular weight of 218.19 g/mol. Its IUPAC name is 2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene.

Molecular Properties

Compound Name2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene
PubChem CID90783714
Molecular FormulaC11H10F4
Molecular Weight218.19 g/mol
Exact Mass218.07
IUPAC Name2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene
SMILESCC=C(F)F.FC(F)=Cc1ccccc1
InChIInChI=1S/C8H6F2.C3H4F2/c9-8(10)6-7-4-2-1-3-5-7;1-2-3(4)5/h1-6H;2H,1H3
InChIKeyCRPPTZNQOHIZLN-UHFFFAOYSA-N
XLogP4.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.19
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

[(E)-2-fluoro-2-iodoethenyl]benzene
CID 11492511
1-(2,2-difluoroethenyl)-4-methylbenzene
CID 6424286
CID 11750295
CID 11750295
1-(2,2-difluoroethenyl)-4-[4-(2,2-difluoroethenyl)phenyl]benzene
CID 129308082
[2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfanylethenyl]benzene
CID 66730141
[(1E)-3-fluoro-2-methylbuta-1,3-dienyl]benzene
CID 12586000
1,2-diphenylethenyl(trimethyl)stannane
CID 85409912
2-fluoro-3-phenylprop-2-enal
CID 54285949
4-phenylhexa-2,4-dien-3-ylbenzene
CID 2802592
1-bromo-4-(1-fluoro-2-phenylethenyl)benzene
CID 154707764
[2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene
CID 68923226
1-(2,2-difluoroethenyl)-4-methylsulfanylbenzene
CID 102110854

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene?
The IUPAC name of 2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene (CID 90783714) is 2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene.
What is the SMILES notation for 2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene?
The canonical SMILES for 2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene is CC=C(F)F.FC(F)=Cc1ccccc1.
What is the InChIKey of 2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene?
The InChIKey is CRPPTZNQOHIZLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F2.C3H4F2/c9-8(10)6-7-4-2-1-3-5-7;1-2-3(4)5/h1-6H;2H,1H3.
What are the key properties of 2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene?
2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene has a molecular weight of 218.19 g/mol, XLogP of 4.71, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene is sourced from PubChem (CID 90783714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).