2,2-difluoropentan-1-ol

C5H10F2O — CID 23381520

IUPAC2,2-difluoropentan-1-ol
SMILESCCCC(F)(F)CO
InChIInChI=1S/C5H10F2O/c1-2-3-5(6,7)4-8/h8H,2-4H2,1H3
InChIKeyMCBXIGYEGIKXLR-UHFFFAOYSA-N
MW124.13 g/mol
LogP1.41
Rot. Bonds3

About 2,2-difluoropentan-1-ol

2,2-difluoropentan-1-ol (PubChem CID 23381520) has the molecular formula C5H10F2O and a molecular weight of 124.13 g/mol. Its IUPAC name is 2,2-difluoropentan-1-ol.

Molecular Properties

Compound Name2,2-difluoropentan-1-ol
PubChem CID23381520
Molecular FormulaC5H10F2O
Molecular Weight124.13 g/mol
Exact Mass124.07
IUPAC Name2,2-difluoropentan-1-ol
SMILESCCCC(F)(F)CO
InChIInChI=1S/C5H10F2O/c1-2-3-5(6,7)4-8/h8H,2-4H2,1H3
InChIKeyMCBXIGYEGIKXLR-UHFFFAOYSA-N
XLogP1.41
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.13
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2,3,3,4,4,5,5-Octafluoro-1-pentanol
CID 9641
4,4,5,5,5-Pentafluoropentan-1-ol
CID 547967
3,3,4,4,5,5,5-Heptafluoropentan-1-ol
CID 2782534
1-Pentanol, 5-fluoro-
CID 120291
5,5,5-Trifluoropentan-1-ol
CID 2769672
2,2-Difluorobutan-1-ol
CID 21880591
3,3-Difluoropentan-1-ol
CID 53682984
3,3-Difluorobutan-1-ol
CID 53831960
4,4-Difluorobutan-1-ol
CID 53976399
4,4-Difluoropentan-1-ol
CID 54148084
5,5,5-Trifluoropentan-2-ol
CID 13620753
2-Fluoropentan-1-ol
CID 21655602

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoropentan-1-ol?
The IUPAC name of 2,2-difluoropentan-1-ol (CID 23381520) is 2,2-difluoropentan-1-ol.
What is the SMILES notation for 2,2-difluoropentan-1-ol?
The canonical SMILES for 2,2-difluoropentan-1-ol is CCCC(F)(F)CO.
What is the InChIKey of 2,2-difluoropentan-1-ol?
The InChIKey is MCBXIGYEGIKXLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10F2O/c1-2-3-5(6,7)4-8/h8H,2-4H2,1H3.
What are the key properties of 2,2-difluoropentan-1-ol?
2,2-difluoropentan-1-ol has a molecular weight of 124.13 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoropentan-1-ol is sourced from PubChem (CID 23381520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).