1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane

C14H16F4 — CID 101465693

IUPAC1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane
SMILESFC12CC3C4CC5(F)CC(C(C1)C3(F)C5)C4(F)C2
InChIInChI=1S/C14H16F4/c15-11-1-7-8-3-12(16)4-10(14(8,18)5-11)9(2-11)13(7,17)6-12/h7-10H,1-6H2
InChIKeyVJEWBMZCTKNFLU-UHFFFAOYSA-N
MW260.27 g/mol
LogP3.69
Rot. Bonds

About 1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane

1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane (PubChem CID 101465693) has the molecular formula C14H16F4 and a molecular weight of 260.27 g/mol. Its IUPAC name is 1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane.

Molecular Properties

Compound Name1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane
PubChem CID101465693
Molecular FormulaC14H16F4
Molecular Weight260.27 g/mol
Exact Mass260.12
IUPAC Name1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane
SMILESFC12CC3C4CC5(F)CC(C(C1)C3(F)C5)C4(F)C2
InChIInChI=1S/C14H16F4/c15-11-1-7-8-3-12(16)4-10(14(8,18)5-11)9(2-11)13(7,17)6-12/h7-10H,1-6H2
InChIKeyVJEWBMZCTKNFLU-UHFFFAOYSA-N
XLogP3.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.27
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane?
The IUPAC name of 1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane (CID 101465693) is 1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane.
What is the SMILES notation for 1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane?
The canonical SMILES for 1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane is FC12CC3C4CC5(F)CC(C(C1)C3(F)C5)C4(F)C2.
What is the InChIKey of 1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane?
The InChIKey is VJEWBMZCTKNFLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F4/c15-11-1-7-8-3-12(16)4-10(14(8,18)5-11)9(2-11)13(7,17)6-12/h7-10H,1-6H2.
What are the key properties of 1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane?
1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane has a molecular weight of 260.27 g/mol, XLogP of 3.69, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,6,9-tetrafluoropentacyclo[7.3.1.14,12.02,7.06,11]tetradecane is sourced from PubChem (CID 101465693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).