2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol

C10H10F8O — CID 58773390

IUPAC2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol
SMILESOC(C(F)(F)F)(C(F)(F)F)C1(F)C2CCC(C2)C1F
InChIInChI=1S/C10H10F8O/c11-6-4-1-2-5(3-4)7(6,12)8(19,9(13,14)15)10(16,17)18/h4-6,19H,1-3H2
InChIKeyLBZGNYAFXBEEMF-UHFFFAOYSA-N
MW298.17 g/mol
LogP3.32
Rot. Bonds1

About 2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol

2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol (PubChem CID 58773390) has the molecular formula C10H10F8O and a molecular weight of 298.17 g/mol. Its IUPAC name is 2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol.

Molecular Properties

Compound Name2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol
PubChem CID58773390
Molecular FormulaC10H10F8O
Molecular Weight298.17 g/mol
Exact Mass298.06
IUPAC Name2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol
SMILESOC(C(F)(F)F)(C(F)(F)F)C1(F)C2CCC(C2)C1F
InChIInChI=1S/C10H10F8O/c11-6-4-1-2-5(3-4)7(6,12)8(19,9(13,14)15)10(16,17)18/h4-6,19H,1-3H2
InChIKeyLBZGNYAFXBEEMF-UHFFFAOYSA-N
XLogP3.32
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.17
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,1,1,3,3,3-hexafluoro-2-(2-fluoro-2-bicyclo[2.2.1]heptanyl)propan-2-ol
CID 20743874
1,1,1,3,3,3-hexafluoro-2-(2-fluoro-2-bicyclo[2.2.1]heptanyl)propan-2-ol;2-methylpropane
CID 91230238
2,2-difluoro-3-[3,3,3-trifluoro-2-methyl-2-(trifluoromethyl)propyl]bicyclo[2.2.1]heptane
CID 20770026
1,1,1,3,3,3-hexafluoro-2-(2,3,3-trifluoro-2-bicyclo[2.2.1]heptanyl)propan-2-ol;3-methyl-3-(trifluoromethyl)pentane
CID 91018341
1,1,1,3,3,3-hexafluoro-2-(3-methyl-1-adamantyl)propan-2-ol
CID 59460064
1,1,1-trifluoro-2-(2-fluoro-2-bicyclo[2.2.1]heptanyl)propan-2-ol
CID 58165688
(1R,2S,4S)-3,3-dimethylbicyclo[2.2.1]heptane-2-carbonitrile
CID 166525664
2-(2,5-difluoro-6-methyl-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol;methane;1,2,2-trifluoropropane
CID 159834698
(1S,2S,4R)-spiro[bicyclo[2.2.1]heptane-3,1'-cyclopropane]-2-ol
CID 15761090
2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 88585675
2-(2-bicyclo[2.2.2]octanylmethyl)-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 59709606
2-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoropropan-2-ol
CID 58958840

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol?
The IUPAC name of 2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol (CID 58773390) is 2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol.
What is the SMILES notation for 2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol?
The canonical SMILES for 2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol is OC(C(F)(F)F)(C(F)(F)F)C1(F)C2CCC(C2)C1F.
What is the InChIKey of 2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol?
The InChIKey is LBZGNYAFXBEEMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F8O/c11-6-4-1-2-5(3-4)7(6,12)8(19,9(13,14)15)10(16,17)18/h4-6,19H,1-3H2.
What are the key properties of 2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol?
2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol has a molecular weight of 298.17 g/mol, XLogP of 3.32, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluoro-2-bicyclo[2.2.1]heptanyl)-1,1,1,3,3,3-hexafluoropropan-2-ol is sourced from PubChem (CID 58773390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).