6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol

C9H10F6O — CID 103310941

IUPAC6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol
SMILESOC1(C(C(F)(F)F)C(F)(F)F)C2CCCC21
InChIInChI=1S/C9H10F6O/c10-8(11,12)6(9(13,14)15)7(16)4-2-1-3-5(4)7/h4-6,16H,1-3H2
InChIKeyMCMGIOGFPWNFHZ-UHFFFAOYSA-N
MW248.17 g/mol
LogP2.89
Rot. Bonds1

About 6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol

6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol (PubChem CID 103310941) has the molecular formula C9H10F6O and a molecular weight of 248.17 g/mol. Its IUPAC name is 6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol.

Molecular Properties

Compound Name6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol
PubChem CID103310941
Molecular FormulaC9H10F6O
Molecular Weight248.17 g/mol
Exact Mass248.06
IUPAC Name6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol
SMILESOC1(C(C(F)(F)F)C(F)(F)F)C2CCCC21
InChIInChI=1S/C9H10F6O/c10-8(11,12)6(9(13,14)15)7(16)4-2-1-3-5(4)7/h4-6,16H,1-3H2
InChIKeyMCMGIOGFPWNFHZ-UHFFFAOYSA-N
XLogP2.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.17
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol?
The IUPAC name of 6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol (CID 103310941) is 6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol.
What is the SMILES notation for 6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol?
The canonical SMILES for 6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol is OC1(C(C(F)(F)F)C(F)(F)F)C2CCCC21.
What is the InChIKey of 6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol?
The InChIKey is MCMGIOGFPWNFHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F6O/c10-8(11,12)6(9(13,14)15)7(16)4-2-1-3-5(4)7/h4-6,16H,1-3H2.
What are the key properties of 6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol?
6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol has a molecular weight of 248.17 g/mol, XLogP of 2.89, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1,1,1,3,3,3-hexafluoropropan-2-yl)bicyclo[3.1.0]hexan-6-ol is sourced from PubChem (CID 103310941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).