[2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol

C5H5F5O — CID 58388254

IUPAC[2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol
SMILESOCC1(C(F)(F)F)CC1(F)F
InChIInChI=1S/C5H5F5O/c6-4(7)1-3(4,2-11)5(8,9)10/h11H,1-2H2
InChIKeyPKMQOEPAXOUYJM-UHFFFAOYSA-N
MW176.08 g/mol
LogP1.57
Rot. Bonds1

About [2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol

[2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol (PubChem CID 58388254) has the molecular formula C5H5F5O and a molecular weight of 176.08 g/mol. Its IUPAC name is [2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol.

Molecular Properties

Compound Name[2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol
PubChem CID58388254
Molecular FormulaC5H5F5O
Molecular Weight176.08 g/mol
Exact Mass176.03
IUPAC Name[2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol
SMILESOCC1(C(F)(F)F)CC1(F)F
InChIInChI=1S/C5H5F5O/c6-4(7)1-3(4,2-11)5(8,9)10/h11H,1-2H2
InChIKeyPKMQOEPAXOUYJM-UHFFFAOYSA-N
XLogP1.57
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.08
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane
CID 121274020
2,2-difluoro-1-(trifluoromethyl)cyclopropane-1-carboxylic acid
CID 58388253
[(1S)-2,2-difluoro-1-methylcyclopropyl]methanol
CID 92980110
1,1,2-triethyl-2-(trifluoromethyl)cyclopropane
CID 121274019
[3,3-difluoro-1-(hydroxymethyl)cyclobutyl]methanol
CID 121207762
(3,5,7-trifluoro-1-adamantyl)methanol
CID 57406555
[(1R)-1-[(6,6-difluoro-2-azaspiro[3.3]heptan-2-yl)methyl]-2,2-difluorocyclopropyl]methanol
CID 172587933
(1-but-1-en-2-yl-2,2-difluorocyclopropyl)methanol
CID 166686930
1,1,2-tris(fluoromethyl)-2-(trifluoromethyl)cyclobutane
CID 172773052
[2,2-difluoro-1-(hydroxymethyl)cyclopropyl]methyl N-methylcarbamate
CID 178038045
[(2S)-2-fluorooxiran-2-yl]methanol
CID 141069449
[(1R)-2,2-difluorocyclopropyl]methanol
CID 7171885

Frequently Asked Questions

What is the IUPAC name of [2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol?
The IUPAC name of [2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol (CID 58388254) is [2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol.
What is the SMILES notation for [2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol?
The canonical SMILES for [2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol is OCC1(C(F)(F)F)CC1(F)F.
What is the InChIKey of [2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol?
The InChIKey is PKMQOEPAXOUYJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5F5O/c6-4(7)1-3(4,2-11)5(8,9)10/h11H,1-2H2.
What are the key properties of [2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol?
[2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol has a molecular weight of 176.08 g/mol, XLogP of 1.57, 1 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)cyclopropyl]methanol is sourced from PubChem (CID 58388254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).