1-cyclopentyl-2,2,2-trifluoroethanol

C7H11F3O — CID 62070207

IUPAC1-cyclopentyl-2,2,2-trifluoroethanol
SMILESOC(C1CCCC1)C(F)(F)F
InChIInChI=1S/C7H11F3O/c8-7(9,10)6(11)5-3-1-2-4-5/h5-6,11H,1-4H2
InChIKeyFVHGYKGHTHSHOX-UHFFFAOYSA-N
MW168.16 g/mol
LogP2.10
Rot. Bonds1

About 1-cyclopentyl-2,2,2-trifluoroethanol

1-cyclopentyl-2,2,2-trifluoroethanol (PubChem CID 62070207) has the molecular formula C7H11F3O and a molecular weight of 168.16 g/mol. Its IUPAC name is 1-cyclopentyl-2,2,2-trifluoroethanol.

Molecular Properties

Compound Name1-cyclopentyl-2,2,2-trifluoroethanol
PubChem CID62070207
Molecular FormulaC7H11F3O
Molecular Weight168.16 g/mol
Exact Mass168.08
IUPAC Name1-cyclopentyl-2,2,2-trifluoroethanol
SMILESOC(C1CCCC1)C(F)(F)F
InChIInChI=1S/C7H11F3O/c8-7(9,10)6(11)5-3-1-2-4-5/h5-6,11H,1-4H2
InChIKeyFVHGYKGHTHSHOX-UHFFFAOYSA-N
XLogP2.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.16
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-Cyclopentylethanol
CID 95434
4-(Trifluoromethyl)cyclohexan-1-ol
CID 2779765
2-(Trifluoromethyl)cyclohexanol
CID 2777485
3-(Trifluoromethyl)cyclohexan-1-ol
CID 2777487
(1S)-1-cyclopentylethan-1-ol
CID 6994473
(1R)-1-cyclopentylethan-1-ol
CID 7000057
(3,3-Difluorocyclopentyl)methanol
CID 59340973
4-(Difluoromethyl)cyclohexan-1-ol
CID 68052207
(1R)-3,3-Difluorocyclopentanemethanol
CID 72208028
2-Cyclopentyl-2-fluoroethan-1-ol
CID 84020601
(2,2-Difluorocyclopentyl)methanol
CID 84020623
3-(Trifluoromethyl)cyclopentan-1-ol
CID 84020902

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2,2,2-trifluoroethanol?
The IUPAC name of 1-cyclopentyl-2,2,2-trifluoroethanol (CID 62070207) is 1-cyclopentyl-2,2,2-trifluoroethanol.
What is the SMILES notation for 1-cyclopentyl-2,2,2-trifluoroethanol?
The canonical SMILES for 1-cyclopentyl-2,2,2-trifluoroethanol is OC(C1CCCC1)C(F)(F)F.
What is the InChIKey of 1-cyclopentyl-2,2,2-trifluoroethanol?
The InChIKey is FVHGYKGHTHSHOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3O/c8-7(9,10)6(11)5-3-1-2-4-5/h5-6,11H,1-4H2.
What are the key properties of 1-cyclopentyl-2,2,2-trifluoroethanol?
1-cyclopentyl-2,2,2-trifluoroethanol has a molecular weight of 168.16 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2,2,2-trifluoroethanol is sourced from PubChem (CID 62070207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).