2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol

C6H7F5O — CID 59440477

IUPAC2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol
SMILESOC1(C(F)(F)F)CCCC1(F)F
InChIInChI=1S/C6H7F5O/c7-5(8)3-1-2-4(5,12)6(9,10)11/h12H,1-3H2
InChIKeyKHNVNPMTCHZWAN-UHFFFAOYSA-N
MW190.11 g/mol
LogP2.10
Rot. Bonds

About 2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol

2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol (PubChem CID 59440477) has the molecular formula C6H7F5O and a molecular weight of 190.11 g/mol. Its IUPAC name is 2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol.

Molecular Properties

Compound Name2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol
PubChem CID59440477
Molecular FormulaC6H7F5O
Molecular Weight190.11 g/mol
Exact Mass190.04
IUPAC Name2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol
SMILESOC1(C(F)(F)F)CCCC1(F)F
InChIInChI=1S/C6H7F5O/c7-5(8)3-1-2-4(5,12)6(9,10)11/h12H,1-3H2
InChIKeyKHNVNPMTCHZWAN-UHFFFAOYSA-N
XLogP2.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.11
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol?
The IUPAC name of 2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol (CID 59440477) is 2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol.
What is the SMILES notation for 2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol?
The canonical SMILES for 2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol is OC1(C(F)(F)F)CCCC1(F)F.
What is the InChIKey of 2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol?
The InChIKey is KHNVNPMTCHZWAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7F5O/c7-5(8)3-1-2-4(5,12)6(9,10)11/h12H,1-3H2.
What are the key properties of 2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol?
2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol has a molecular weight of 190.11 g/mol, XLogP of 2.10, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-1-(trifluoromethyl)cyclopentan-1-ol is sourced from PubChem (CID 59440477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).