6-(difluoromethylidene)-8-phenyloctan-4-ol

C15H20F2O — CID 162419635

IUPAC6-(difluoromethylidene)-8-phenyloctan-4-ol
SMILESCCCC(O)CC(CCc1ccccc1)=C(F)F
InChIInChI=1S/C15H20F2O/c1-2-6-14(18)11-13(15(16)17)10-9-12-7-4-3-5-8-12/h3-5,7-8,14,18H,2,6,9-11H2,1H3
InChIKeyOYRUTBDJZHWYSU-UHFFFAOYSA-N
MW254.32 g/mol
LogP4.32
Rot. Bonds7

About 6-(difluoromethylidene)-8-phenyloctan-4-ol

6-(difluoromethylidene)-8-phenyloctan-4-ol (PubChem CID 162419635) has the molecular formula C15H20F2O and a molecular weight of 254.32 g/mol. Its IUPAC name is 6-(difluoromethylidene)-8-phenyloctan-4-ol.

Molecular Properties

Compound Name6-(difluoromethylidene)-8-phenyloctan-4-ol
PubChem CID162419635
Molecular FormulaC15H20F2O
Molecular Weight254.32 g/mol
Exact Mass254.15
IUPAC Name6-(difluoromethylidene)-8-phenyloctan-4-ol
SMILESCCCC(O)CC(CCc1ccccc1)=C(F)F
InChIInChI=1S/C15H20F2O/c1-2-6-14(18)11-13(15(16)17)10-9-12-7-4-3-5-8-12/h3-5,7-8,14,18H,2,6,9-11H2,1H3
InChIKeyOYRUTBDJZHWYSU-UHFFFAOYSA-N
XLogP4.32
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.32
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-Phenylethanol
CID 6054
1-Phenylethanol
CID 7409
1-Phenyl-1-propanol
CID 7147
Fenipentol
CID 3338
Benzenepropanol
CID 31234
1-Phenyl-3-methyl-3-pentanol
CID 61516
2-Methyl-4-phenyl-2-butanol
CID 7632
2-Methyl-1-phenyl-2-propanol
CID 7531
alpha-(2-Methylpropyl)benzeneethanol
CID 62661
2-Phenyl-1-propanol
CID 14295
4-Phenyl-2-butanol
CID 61302
5-Phenyl-1-pentanol
CID 61523

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethylidene)-8-phenyloctan-4-ol?
The IUPAC name of 6-(difluoromethylidene)-8-phenyloctan-4-ol (CID 162419635) is 6-(difluoromethylidene)-8-phenyloctan-4-ol.
What is the SMILES notation for 6-(difluoromethylidene)-8-phenyloctan-4-ol?
The canonical SMILES for 6-(difluoromethylidene)-8-phenyloctan-4-ol is CCCC(O)CC(CCc1ccccc1)=C(F)F.
What is the InChIKey of 6-(difluoromethylidene)-8-phenyloctan-4-ol?
The InChIKey is OYRUTBDJZHWYSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2O/c1-2-6-14(18)11-13(15(16)17)10-9-12-7-4-3-5-8-12/h3-5,7-8,14,18H,2,6,9-11H2,1H3.
What are the key properties of 6-(difluoromethylidene)-8-phenyloctan-4-ol?
6-(difluoromethylidene)-8-phenyloctan-4-ol has a molecular weight of 254.32 g/mol, XLogP of 4.32, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethylidene)-8-phenyloctan-4-ol is sourced from PubChem (CID 162419635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).