2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol

C11H10F8O — CID 22088757

IUPAC2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol
SMILESCC1(O)CC2CC1C1(F)C(F)(F)C(F)(F)C(F)(F)C21F
InChIInChI=1S/C11H10F8O/c1-6(20)3-4-2-5(6)8(13)7(4,12)9(14,15)11(18,19)10(8,16)17/h4-5,20H,2-3H2,1H3
InChIKeyFGLJWQXLWMRZKN-UHFFFAOYSA-N
MW310.18 g/mol
LogP3.11
Rot. Bonds

About 2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol

2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol (PubChem CID 22088757) has the molecular formula C11H10F8O and a molecular weight of 310.18 g/mol. Its IUPAC name is 2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol.

Molecular Properties

Compound Name2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol
PubChem CID22088757
Molecular FormulaC11H10F8O
Molecular Weight310.18 g/mol
Exact Mass310.06
IUPAC Name2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol
SMILESCC1(O)CC2CC1C1(F)C(F)(F)C(F)(F)C(F)(F)C21F
InChIInChI=1S/C11H10F8O/c1-6(20)3-4-2-5(6)8(13)7(4,12)9(14,15)11(18,19)10(8,16)17/h4-5,20H,2-3H2,1H3
InChIKeyFGLJWQXLWMRZKN-UHFFFAOYSA-N
XLogP3.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.18
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol?
The IUPAC name of 2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol (CID 22088757) is 2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol.
What is the SMILES notation for 2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol?
The canonical SMILES for 2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol is CC1(O)CC2CC1C1(F)C(F)(F)C(F)(F)C(F)(F)C21F.
What is the InChIKey of 2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol?
The InChIKey is FGLJWQXLWMRZKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F8O/c1-6(20)3-4-2-5(6)8(13)7(4,12)9(14,15)11(18,19)10(8,16)17/h4-5,20H,2-3H2,1H3.
What are the key properties of 2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol?
2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol has a molecular weight of 310.18 g/mol, XLogP of 3.11, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3,4,4,5,5,6-octafluoro-8-methyltricyclo[5.2.1.02,6]decan-8-ol is sourced from PubChem (CID 22088757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).