2-ethenyl-1,3-difluoro-4-methylbenzene

C9H8F2 — CID 134441923

IUPAC2-ethenyl-1,3-difluoro-4-methylbenzene
SMILESC=Cc1c(F)ccc(C)c1F
InChIInChI=1S/C9H8F2/c1-3-7-8(10)5-4-6(2)9(7)11/h3-5H,1H2,2H3
InChIKeyXUGNMAUJRBMBKY-UHFFFAOYSA-N
MW154.16 g/mol
LogP2.92
Rot. Bonds1

About 2-ethenyl-1,3-difluoro-4-methylbenzene

2-ethenyl-1,3-difluoro-4-methylbenzene (PubChem CID 134441923) has the molecular formula C9H8F2 and a molecular weight of 154.16 g/mol. Its IUPAC name is 2-ethenyl-1,3-difluoro-4-methylbenzene.

Molecular Properties

Compound Name2-ethenyl-1,3-difluoro-4-methylbenzene
PubChem CID134441923
Molecular FormulaC9H8F2
Molecular Weight154.16 g/mol
Exact Mass154.06
IUPAC Name2-ethenyl-1,3-difluoro-4-methylbenzene
SMILESC=Cc1c(F)ccc(C)c1F
InChIInChI=1S/C9H8F2/c1-3-7-8(10)5-4-6(2)9(7)11/h3-5H,1H2,2H3
InChIKeyXUGNMAUJRBMBKY-UHFFFAOYSA-N
XLogP2.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.16
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-1,3-difluoro-4-methylbenzene?
The IUPAC name of 2-ethenyl-1,3-difluoro-4-methylbenzene (CID 134441923) is 2-ethenyl-1,3-difluoro-4-methylbenzene.
What is the SMILES notation for 2-ethenyl-1,3-difluoro-4-methylbenzene?
The canonical SMILES for 2-ethenyl-1,3-difluoro-4-methylbenzene is C=Cc1c(F)ccc(C)c1F.
What is the InChIKey of 2-ethenyl-1,3-difluoro-4-methylbenzene?
The InChIKey is XUGNMAUJRBMBKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F2/c1-3-7-8(10)5-4-6(2)9(7)11/h3-5H,1H2,2H3.
What are the key properties of 2-ethenyl-1,3-difluoro-4-methylbenzene?
2-ethenyl-1,3-difluoro-4-methylbenzene has a molecular weight of 154.16 g/mol, XLogP of 2.92, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-1,3-difluoro-4-methylbenzene is sourced from PubChem (CID 134441923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).