5-(2,4-difluorophenyl)pentan-2-ol

C11H14F2O — CID 64516740

IUPAC5-(2,4-difluorophenyl)pentan-2-ol
SMILESCC(O)CCCc1ccc(F)cc1F
InChIInChI=1S/C11H14F2O/c1-8(14)3-2-4-9-5-6-10(12)7-11(9)13/h5-8,14H,2-4H2,1H3
InChIKeyFCSOGUOSXZDYDN-UHFFFAOYSA-N
MW200.23 g/mol
LogP2.67
Rot. Bonds4

About 5-(2,4-difluorophenyl)pentan-2-ol

5-(2,4-difluorophenyl)pentan-2-ol (PubChem CID 64516740) has the molecular formula C11H14F2O and a molecular weight of 200.23 g/mol. Its IUPAC name is 5-(2,4-difluorophenyl)pentan-2-ol.

Molecular Properties

Compound Name5-(2,4-difluorophenyl)pentan-2-ol
PubChem CID64516740
Molecular FormulaC11H14F2O
Molecular Weight200.23 g/mol
Exact Mass200.10
IUPAC Name5-(2,4-difluorophenyl)pentan-2-ol
SMILESCC(O)CCCc1ccc(F)cc1F
InChIInChI=1S/C11H14F2O/c1-8(14)3-2-4-9-5-6-10(12)7-11(9)13/h5-8,14H,2-4H2,1H3
InChIKeyFCSOGUOSXZDYDN-UHFFFAOYSA-N
XLogP2.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.23
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(2,4-difluorophenyl)-2-methylbutanoic acid
CID 81009481
1-(2,4-difluorophenyl)-4,4-dimethylpentan-3-ol
CID 62197542
4-(2,4-difluorophenyl)butyl-hydroxy-di(propan-2-yl)silane
CID 90172191
2,4-difluoro-1-pentylbenzene
CID 20770613
(2S)-5-(4-fluoro-2-phenylmethoxyphenyl)pentan-2-ol
CID 173039005
5-(5-bromo-2-fluorophenyl)pentan-2-ol
CID 64514586
6-(2,4,6-trifluorophenyl)hexan-2-ol
CID 174718688
1-(2,4-difluorophenyl)-8-phenylnonan-3-ol
CID 58861727
6-(4-bromo-2-fluorophenyl)-2-methylhexan-3-ol
CID 64515603
CID 90171923
CID 90171923
1-(2,4-difluorophenyl)propan-2-amine;hydrochloride
CID 155973682
1-(2,4-difluorophenyl)butan-2-ol
CID 23056492

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-difluorophenyl)pentan-2-ol?
The IUPAC name of 5-(2,4-difluorophenyl)pentan-2-ol (CID 64516740) is 5-(2,4-difluorophenyl)pentan-2-ol.
What is the SMILES notation for 5-(2,4-difluorophenyl)pentan-2-ol?
The canonical SMILES for 5-(2,4-difluorophenyl)pentan-2-ol is CC(O)CCCc1ccc(F)cc1F.
What is the InChIKey of 5-(2,4-difluorophenyl)pentan-2-ol?
The InChIKey is FCSOGUOSXZDYDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2O/c1-8(14)3-2-4-9-5-6-10(12)7-11(9)13/h5-8,14H,2-4H2,1H3.
What are the key properties of 5-(2,4-difluorophenyl)pentan-2-ol?
5-(2,4-difluorophenyl)pentan-2-ol has a molecular weight of 200.23 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-difluorophenyl)pentan-2-ol is sourced from PubChem (CID 64516740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).