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

C11H14F2O — CID 71070342

IUPAC5-[(E)-2-fluoroethenyl]-6-[(Z)-1-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran
SMILESC/C=C(\F)C1=C(/C=C/F)CC(C)CO1
InChIInChI=1S/C11H14F2O/c1-3-10(13)11-9(4-5-12)6-8(2)7-14-11/h3-5,8H,6-7H2,1-2H3/b5-4+,10-3-
InChIKeyJWJUWIMVZNJAMP-IMXHIACISA-N
MW200.23 g/mol
LogP3.65
Rot. Bonds2

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

5-[(E)-2-fluoroethenyl]-6-[(Z)-1-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran (PubChem CID 71070342) has the molecular formula C11H14F2O and a molecular weight of 200.23 g/mol. Its IUPAC name is 5-[(E)-2-fluoroethenyl]-6-[(Z)-1-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Name5-[(E)-2-fluoroethenyl]-6-[(Z)-1-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran
PubChem CID71070342
Molecular FormulaC11H14F2O
Molecular Weight200.23 g/mol
Exact Mass200.10
IUPAC Name5-[(E)-2-fluoroethenyl]-6-[(Z)-1-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran
SMILESC/C=C(\F)C1=C(/C=C/F)CC(C)CO1
InChIInChI=1S/C11H14F2O/c1-3-10(13)11-9(4-5-12)6-8(2)7-14-11/h3-5,8H,6-7H2,1-2H3/b5-4+,10-3-
InChIKeyJWJUWIMVZNJAMP-IMXHIACISA-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 5-[(E)-2-fluoroethenyl]-6-[(Z)-1-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran?
The IUPAC name of 5-[(E)-2-fluoroethenyl]-6-[(Z)-1-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran (CID 71070342) is 5-[(E)-2-fluoroethenyl]-6-[(Z)-1-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran.
What is the SMILES notation for 5-[(E)-2-fluoroethenyl]-6-[(Z)-1-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran?
The canonical SMILES for 5-[(E)-2-fluoroethenyl]-6-[(Z)-1-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran is C/C=C(\F)C1=C(/C=C/F)CC(C)CO1.
What is the InChIKey of 5-[(E)-2-fluoroethenyl]-6-[(Z)-1-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran?
The InChIKey is JWJUWIMVZNJAMP-IMXHIACISA-N. The full InChI is InChI=1S/C11H14F2O/c1-3-10(13)11-9(4-5-12)6-8(2)7-14-11/h3-5,8H,6-7H2,1-2H3/b5-4+,10-3-.
What are the key properties of 5-[(E)-2-fluoroethenyl]-6-[(Z)-1-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran?
5-[(E)-2-fluoroethenyl]-6-[(Z)-1-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 5-[(E)-2-fluoroethenyl]-6-[(Z)-1-fluoroprop-1-enyl]-3-methyl-3,4-dihydro-2H-pyran is sourced from PubChem (CID 71070342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).