2,2,3,6,6,7-hexafluoronaphthalene

C10H4F6 — CID 162536554

IUPAC2,2,3,6,6,7-hexafluoronaphthalene
SMILESFC1=CC2=CC(F)(F)C(F)=CC2=CC1(F)F
InChIInChI=1S/C10H4F6/c11-7-1-5-3-10(15,16)8(12)2-6(5)4-9(7,13)14/h1-4H
InChIKeyBKXPFSMQECRODT-UHFFFAOYSA-N
MW238.13 g/mol
LogP3.84
Rot. Bonds

About 2,2,3,6,6,7-hexafluoronaphthalene

2,2,3,6,6,7-hexafluoronaphthalene (PubChem CID 162536554) has the molecular formula C10H4F6 and a molecular weight of 238.13 g/mol. Its IUPAC name is 2,2,3,6,6,7-hexafluoronaphthalene.

Molecular Properties

Compound Name2,2,3,6,6,7-hexafluoronaphthalene
PubChem CID162536554
Molecular FormulaC10H4F6
Molecular Weight238.13 g/mol
Exact Mass238.02
IUPAC Name2,2,3,6,6,7-hexafluoronaphthalene
SMILESFC1=CC2=CC(F)(F)C(F)=CC2=CC1(F)F
InChIInChI=1S/C10H4F6/c11-7-1-5-3-10(15,16)8(12)2-6(5)4-9(7,13)14/h1-4H
InChIKeyBKXPFSMQECRODT-UHFFFAOYSA-N
XLogP3.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.13
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,2,3,6,6,7-hexafluoronaphthalene?
The IUPAC name of 2,2,3,6,6,7-hexafluoronaphthalene (CID 162536554) is 2,2,3,6,6,7-hexafluoronaphthalene.
What is the SMILES notation for 2,2,3,6,6,7-hexafluoronaphthalene?
The canonical SMILES for 2,2,3,6,6,7-hexafluoronaphthalene is FC1=CC2=CC(F)(F)C(F)=CC2=CC1(F)F.
What is the InChIKey of 2,2,3,6,6,7-hexafluoronaphthalene?
The InChIKey is BKXPFSMQECRODT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H4F6/c11-7-1-5-3-10(15,16)8(12)2-6(5)4-9(7,13)14/h1-4H.
What are the key properties of 2,2,3,6,6,7-hexafluoronaphthalene?
2,2,3,6,6,7-hexafluoronaphthalene has a molecular weight of 238.13 g/mol, XLogP of 3.84, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,6,6,7-hexafluoronaphthalene is sourced from PubChem (CID 162536554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).