3,3-difluoro-2-(4-methylphenyl)-2H-furan

C11H10F2O — CID 23655998

IUPAC3,3-difluoro-2-(4-methylphenyl)-2H-furan
SMILESCc1ccc(C2OC=CC2(F)F)cc1
InChIInChI=1S/C11H10F2O/c1-8-2-4-9(5-3-8)10-11(12,13)6-7-14-10/h2-7,10H,1H3
InChIKeyCJIDEAJYPVDNMY-UHFFFAOYSA-N
MW196.20 g/mol
LogP3.22
Rot. Bonds1

About 3,3-difluoro-2-(4-methylphenyl)-2H-furan

3,3-difluoro-2-(4-methylphenyl)-2H-furan (PubChem CID 23655998) has the molecular formula C11H10F2O and a molecular weight of 196.20 g/mol. Its IUPAC name is 3,3-difluoro-2-(4-methylphenyl)-2H-furan.

Molecular Properties

Compound Name3,3-difluoro-2-(4-methylphenyl)-2H-furan
PubChem CID23655998
Molecular FormulaC11H10F2O
Molecular Weight196.20 g/mol
Exact Mass196.07
IUPAC Name3,3-difluoro-2-(4-methylphenyl)-2H-furan
SMILESCc1ccc(C2OC=CC2(F)F)cc1
InChIInChI=1S/C11H10F2O/c1-8-2-4-9(5-3-8)10-11(12,13)6-7-14-10/h2-7,10H,1H3
InChIKeyCJIDEAJYPVDNMY-UHFFFAOYSA-N
XLogP3.22
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.20
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(1S)-2,2-difluorocyclopropyl]-4-methylbenzene
CID 52630352
1-(2,2-difluorocyclopropyl)-4-methylbenzene
CID 25210513
3-(4-methylphenyl)oxirane-2,2-dicarbonitrile
CID 10877791
(2S,3S)-3-methyl-2-(4-methylphenyl)-2,3-dihydrofuran
CID 134955528
benzene;ethane;1-methyl-4-(4-methylphenyl)benzene
CID 161197560
1-cyclopropyl-4-methylbenzene;ethane;methane
CID 164862835
1-methyl-4-[4-[4-(4-methylphenyl)cyclohexyl]phenyl]benzene
CID 59265320
1-[(1R)-2,2-dimethylcyclopropyl]-4-methylbenzene
CID 144562671
difluoro-tris(4-methylphenyl)-lambda5-phosphane
CID 15182993
2-(4-methylphenyl)-2H-1,3-oxazol-5-one
CID 70370917
ethane;methanol;1,4-xylene
CID 171074418
2,2-dimethyl-4-(4-methylphenyl)oxetane
CID 12731994

Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-2-(4-methylphenyl)-2H-furan?
The IUPAC name of 3,3-difluoro-2-(4-methylphenyl)-2H-furan (CID 23655998) is 3,3-difluoro-2-(4-methylphenyl)-2H-furan.
What is the SMILES notation for 3,3-difluoro-2-(4-methylphenyl)-2H-furan?
The canonical SMILES for 3,3-difluoro-2-(4-methylphenyl)-2H-furan is Cc1ccc(C2OC=CC2(F)F)cc1.
What is the InChIKey of 3,3-difluoro-2-(4-methylphenyl)-2H-furan?
The InChIKey is CJIDEAJYPVDNMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F2O/c1-8-2-4-9(5-3-8)10-11(12,13)6-7-14-10/h2-7,10H,1H3.
What are the key properties of 3,3-difluoro-2-(4-methylphenyl)-2H-furan?
3,3-difluoro-2-(4-methylphenyl)-2H-furan has a molecular weight of 196.20 g/mol, XLogP of 3.22, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-2-(4-methylphenyl)-2H-furan is sourced from PubChem (CID 23655998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).