2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol

C15H20F2O2 — CID 176902887

IUPAC2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol
SMILESCC(O)CC1CCC(c2ccc(O)c(F)c2F)CC1
InChIInChI=1S/C15H20F2O2/c1-9(18)8-10-2-4-11(5-3-10)12-6-7-13(19)15(17)14(12)16/h6-7,9-11,18-19H,2-5,8H2,1H3
InChIKeyPFJMJGALPAKBEH-UHFFFAOYSA-N
MW270.32 g/mol
LogP3.72
Rot. Bonds3

About 2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol

2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol (PubChem CID 176902887) has the molecular formula C15H20F2O2 and a molecular weight of 270.32 g/mol. Its IUPAC name is 2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol.

Molecular Properties

Compound Name2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol
PubChem CID176902887
Molecular FormulaC15H20F2O2
Molecular Weight270.32 g/mol
Exact Mass270.14
IUPAC Name2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol
SMILESCC(O)CC1CCC(c2ccc(O)c(F)c2F)CC1
InChIInChI=1S/C15H20F2O2/c1-9(18)8-10-2-4-11(5-3-10)12-6-7-13(19)15(17)14(12)16/h6-7,9-11,18-19H,2-5,8H2,1H3
InChIKeyPFJMJGALPAKBEH-UHFFFAOYSA-N
XLogP3.72
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.32
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluorophenol
CID 164913639
4-cyclohexyl-2,3-difluorophenol
CID 134218235
1-[4-(2-hydroxypropyl)cyclohexyl]propan-2-ol
CID 19387430
4-[4-[4-[[4-[2,3-difluoro-4-(1-hydroxybutyl)phenyl]cyclohexyl]oxymethyl]cyclohexyl]-2,3-difluorophenyl]-2,3-difluorophenol
CID 88893988
2,3-difluoro-4-(3-hydroxy-4-propylcyclohexyl)phenol
CID 176902879
4-[[4-[4-(4-ethoxy-2,3-difluorophenyl)cyclohexyl]-2,3-difluorophenoxy]methyl]-2,3-difluorophenol
CID 122643430
[4-[4-(2,3-difluoro-4-methylphenyl)cyclohexyl]cyclohexyl]methanol
CID 58058777
1-[4-(4-ethoxy-2,3-difluorophenyl)cyclohexyl]propan-1-ol
CID 118967053
(3-cyclopropyl-2-fluoro-6-hydroxyphenyl)boronic acid
CID 171781999
[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-(4-methylcyclohexyl)methanol
CID 134358796
4-[4-[2-[4-[4-(4-ethoxy-2,3-difluorophenyl)cyclohexyl]cyclohexyl]ethyl]-2,3-difluorophenyl]-2,3-difluorophenol
CID 88893763
2-[4-[4-(4-ethylcyclohexyl)cyclohexyl]-2,3-difluorophenoxy]ethane-1,1-diol
CID 178066806

Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol?
The IUPAC name of 2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol (CID 176902887) is 2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol.
What is the SMILES notation for 2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol?
The canonical SMILES for 2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol is CC(O)CC1CCC(c2ccc(O)c(F)c2F)CC1.
What is the InChIKey of 2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol?
The InChIKey is PFJMJGALPAKBEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2O2/c1-9(18)8-10-2-4-11(5-3-10)12-6-7-13(19)15(17)14(12)16/h6-7,9-11,18-19H,2-5,8H2,1H3.
What are the key properties of 2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol?
2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol has a molecular weight of 270.32 g/mol, XLogP of 3.72, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-4-[4-(2-hydroxypropyl)cyclohexyl]phenol is sourced from PubChem (CID 176902887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).