1-(2,4-difluorophenyl)decan-2-ol

C16H24F2O — CID 64559073

IUPAC1-(2,4-difluorophenyl)decan-2-ol
SMILESCCCCCCCCC(O)Cc1ccc(F)cc1F
InChIInChI=1S/C16H24F2O/c1-2-3-4-5-6-7-8-15(19)11-13-9-10-14(17)12-16(13)18/h9-10,12,15,19H,2-8,11H2,1H3
InChIKeyGRLNGTARHANAFS-UHFFFAOYSA-N
MW270.36 g/mol
LogP4.62
Rot. Bonds9

About 1-(2,4-difluorophenyl)decan-2-ol

1-(2,4-difluorophenyl)decan-2-ol (PubChem CID 64559073) has the molecular formula C16H24F2O and a molecular weight of 270.36 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)decan-2-ol.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)decan-2-ol
PubChem CID64559073
Molecular FormulaC16H24F2O
Molecular Weight270.36 g/mol
Exact Mass270.18
IUPAC Name1-(2,4-difluorophenyl)decan-2-ol
SMILESCCCCCCCCC(O)Cc1ccc(F)cc1F
InChIInChI=1S/C16H24F2O/c1-2-3-4-5-6-7-8-15(19)11-13-9-10-14(17)12-16(13)18/h9-10,12,15,19H,2-8,11H2,1H3
InChIKeyGRLNGTARHANAFS-UHFFFAOYSA-N
XLogP4.62
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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1-(2-bromo-5-fluorophenyl)nonan-2-ol
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CID 23056492
1-(2-fluorophenyl)octan-2-ol
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CID 64560625
1-(2,4-difluorophenyl)hept-6-en-2-ol
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1-(2,3-difluorophenyl)dodecan-2-ol
CID 115789113
1-(2-ethylhexyl)-2,4-difluorobenzene;titanium
CID 174433926
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CID 20770613
1-(2-chloro-4-fluorophenyl)pentan-2-ol
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Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)decan-2-ol?
The IUPAC name of 1-(2,4-difluorophenyl)decan-2-ol (CID 64559073) is 1-(2,4-difluorophenyl)decan-2-ol.
What is the SMILES notation for 1-(2,4-difluorophenyl)decan-2-ol?
The canonical SMILES for 1-(2,4-difluorophenyl)decan-2-ol is CCCCCCCCC(O)Cc1ccc(F)cc1F.
What is the InChIKey of 1-(2,4-difluorophenyl)decan-2-ol?
The InChIKey is GRLNGTARHANAFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24F2O/c1-2-3-4-5-6-7-8-15(19)11-13-9-10-14(17)12-16(13)18/h9-10,12,15,19H,2-8,11H2,1H3.
What are the key properties of 1-(2,4-difluorophenyl)decan-2-ol?
1-(2,4-difluorophenyl)decan-2-ol has a molecular weight of 270.36 g/mol, XLogP of 4.62, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)decan-2-ol is sourced from PubChem (CID 64559073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).