1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene

C15H12F2 — CID 156698109

IUPAC1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene
SMILESC=C(c1ccc(C)cc1)c1c(F)cccc1F
InChIInChI=1S/C15H12F2/c1-10-6-8-12(9-7-10)11(2)15-13(16)4-3-5-14(15)17/h3-9H,2H2,1H3
InChIKeyWLOQMDXJPADYEV-UHFFFAOYSA-N
MW230.26 g/mol
LogP4.33
Rot. Bonds2

About 1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene

1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene (PubChem CID 156698109) has the molecular formula C15H12F2 and a molecular weight of 230.26 g/mol. Its IUPAC name is 1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene.

Molecular Properties

Compound Name1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene
PubChem CID156698109
Molecular FormulaC15H12F2
Molecular Weight230.26 g/mol
Exact Mass230.09
IUPAC Name1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene
SMILESC=C(c1ccc(C)cc1)c1c(F)cccc1F
InChIInChI=1S/C15H12F2/c1-10-6-8-12(9-7-10)11(2)15-13(16)4-3-5-14(15)17/h3-9H,2H2,1H3
InChIKeyWLOQMDXJPADYEV-UHFFFAOYSA-N
XLogP4.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,4-bis[1-(4-methylphenyl)ethenyl]benzene;ethane
CID 123373957
1-fluoro-2-[3-(4-methylphenyl)but-3-en-2-yl]benzene
CID 146437749
ethane;1-fluoro-3-methyl-2-prop-1-en-2-ylbenzene
CID 163302643
1-methyl-4-[1-[4-(trifluoromethyl)phenyl]ethenyl]benzene
CID 101368482
[(1S)-1,2-bis(4-methylphenyl)-2-oxoethyl] 2,6-difluorobenzoate
CID 7725581
2,6-difluoro-N-(4-methylphenyl)benzamide;ethane
CID 143234800
2-bromo-6-fluoro-N-methyl-N-(4-methylphenyl)benzamide
CID 113251002
1-methyl-4-prop-1-en-2-ylbenzene
CID 90700010
1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene
CID 20594776
1-(2,6-difluorophenyl)-2-(4-methylphenyl)sulfanylethanone
CID 43802208
2,6-difluoro-N-[(4-methylphenyl)methyl]benzamide
CID 8781288
2-fluoro-6-[(4-methylphenyl)methylamino]benzoic acid
CID 79522270

Frequently Asked Questions

What is the IUPAC name of 1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene?
The IUPAC name of 1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene (CID 156698109) is 1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene.
What is the SMILES notation for 1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene?
The canonical SMILES for 1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene is C=C(c1ccc(C)cc1)c1c(F)cccc1F.
What is the InChIKey of 1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene?
The InChIKey is WLOQMDXJPADYEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F2/c1-10-6-8-12(9-7-10)11(2)15-13(16)4-3-5-14(15)17/h3-9H,2H2,1H3.
What are the key properties of 1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene?
1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene has a molecular weight of 230.26 g/mol, XLogP of 4.33, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-difluoro-2-[1-(4-methylphenyl)ethenyl]benzene is sourced from PubChem (CID 156698109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).