2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol

C15H20F2O2 — CID 65145450

IUPAC2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol
SMILESOC(CC1CCCCC1)c1ccc(OC(F)F)cc1
InChIInChI=1S/C15H20F2O2/c16-15(17)19-13-8-6-12(7-9-13)14(18)10-11-4-2-1-3-5-11/h6-9,11,14-15,18H,1-5,10H2
InChIKeyYWKHCGQODCKTNK-UHFFFAOYSA-N
MW270.32 g/mol
LogP4.29
Rot. Bonds5

About 2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol

2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol (PubChem CID 65145450) has the molecular formula C15H20F2O2 and a molecular weight of 270.32 g/mol. Its IUPAC name is 2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol.

Molecular Properties

Compound Name2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol
PubChem CID65145450
Molecular FormulaC15H20F2O2
Molecular Weight270.32 g/mol
Exact Mass270.14
IUPAC Name2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol
SMILESOC(CC1CCCCC1)c1ccc(OC(F)F)cc1
InChIInChI=1S/C15H20F2O2/c16-15(17)19-13-8-6-12(7-9-13)14(18)10-11-4-2-1-3-5-11/h6-9,11,14-15,18H,1-5,10H2
InChIKeyYWKHCGQODCKTNK-UHFFFAOYSA-N
XLogP4.29
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.32
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol?
The IUPAC name of 2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol (CID 65145450) is 2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol.
What is the SMILES notation for 2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol?
The canonical SMILES for 2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol is OC(CC1CCCCC1)c1ccc(OC(F)F)cc1.
What is the InChIKey of 2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol?
The InChIKey is YWKHCGQODCKTNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2O2/c16-15(17)19-13-8-6-12(7-9-13)14(18)10-11-4-2-1-3-5-11/h6-9,11,14-15,18H,1-5,10H2.
What are the key properties of 2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol?
2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol has a molecular weight of 270.32 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol is sourced from PubChem (CID 65145450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).