6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran

C11H14F2O — CID 89247424

IUPAC6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran
SMILESC=C(F)C1=C(/C=C(\C)F)CC(C)CO1
InChIInChI=1S/C11H14F2O/c1-7-4-10(5-8(2)12)11(9(3)13)14-6-7/h5,7H,3-4,6H2,1-2H3/b8-5+
InChIKeyNPBMHGPMBFHFNS-VMPITWQZSA-N
MW200.23 g/mol
LogP3.65
Rot. Bonds2

About 6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran

6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran (PubChem CID 89247424) has the molecular formula C11H14F2O and a molecular weight of 200.23 g/mol. Its IUPAC name is 6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Name6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran
PubChem CID89247424
Molecular FormulaC11H14F2O
Molecular Weight200.23 g/mol
Exact Mass200.10
IUPAC Name6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran
SMILESC=C(F)C1=C(/C=C(\C)F)CC(C)CO1
InChIInChI=1S/C11H14F2O/c1-7-4-10(5-8(2)12)11(9(3)13)14-6-7/h5,7H,3-4,6H2,1-2H3/b8-5+
InChIKeyNPBMHGPMBFHFNS-VMPITWQZSA-N
XLogP3.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.23
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran?
The IUPAC name of 6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran (CID 89247424) is 6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran.
What is the SMILES notation for 6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran?
The canonical SMILES for 6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran is C=C(F)C1=C(/C=C(\C)F)CC(C)CO1.
What is the InChIKey of 6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran?
The InChIKey is NPBMHGPMBFHFNS-VMPITWQZSA-N. The full InChI is InChI=1S/C11H14F2O/c1-7-4-10(5-8(2)12)11(9(3)13)14-6-7/h5,7H,3-4,6H2,1-2H3/b8-5+.
What are the key properties of 6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran?
6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran has a molecular weight of 200.23 g/mol, XLogP of 3.65, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-fluoroethenyl)-5-[(E)-2-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran is sourced from PubChem (CID 89247424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).