3-(3-hydroxycyclohexyl)oxyphenol

C12H16O3 — CID 117095404

IUPAC3-(3-hydroxycyclohexyl)oxyphenol
SMILESOc1cccc(OC2CCCC(O)C2)c1
InChIInChI=1S/C12H16O3/c13-9-3-1-5-11(7-9)15-12-6-2-4-10(14)8-12/h1,3,5,7,10,12-14H,2,4,6,8H2
InChIKeyBZOBFYJOVXWZRV-UHFFFAOYSA-N
MW208.26 g/mol
LogP2.07
Rot. Bonds2

About 3-(3-hydroxycyclohexyl)oxyphenol

3-(3-hydroxycyclohexyl)oxyphenol (PubChem CID 117095404) has the molecular formula C12H16O3 and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-(3-hydroxycyclohexyl)oxyphenol.

Molecular Properties

Compound Name3-(3-hydroxycyclohexyl)oxyphenol
PubChem CID117095404
Molecular FormulaC12H16O3
Molecular Weight208.26 g/mol
Exact Mass208.11
IUPAC Name3-(3-hydroxycyclohexyl)oxyphenol
SMILESOc1cccc(OC2CCCC(O)C2)c1
InChIInChI=1S/C12H16O3/c13-9-3-1-5-11(7-9)15-12-6-2-4-10(14)8-12/h1,3,5,7,10,12-14H,2,4,6,8H2
InChIKeyBZOBFYJOVXWZRV-UHFFFAOYSA-N
XLogP2.07
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-phenoxycyclohexan-1-ol
CID 79617811
3-(3-propan-2-ylphenoxy)cyclohexan-1-ol
CID 79618801
3-(3-hydroxycyclohexyl)oxybenzonitrile
CID 117052718
3-(4-chlorophenoxy)cyclohexan-1-ol
CID 123350797
3-(4-benzylphenoxy)cyclohexan-1-ol
CID 79599479
3-pyrrolidin-3-yloxyphenol
CID 83482218
3-(3-methyl-4-propan-2-ylphenoxy)cyclohexan-1-ol
CID 79618028
3-(3-ethylphenoxy)cyclopentan-1-ol
CID 79632352
3-(4-pyridin-3-ylphenoxy)cyclohexan-1-ol
CID 117051625
cis-(1R,3S)-3-(1H-indazol-5-yloxy)cyclohexan-1-ol
CID 97056382
CID 22942593
CID 22942593
2,5-dicyclohexyloxyphenol
CID 139941916

Frequently Asked Questions

What is the IUPAC name of 3-(3-hydroxycyclohexyl)oxyphenol?
The IUPAC name of 3-(3-hydroxycyclohexyl)oxyphenol (CID 117095404) is 3-(3-hydroxycyclohexyl)oxyphenol.
What is the SMILES notation for 3-(3-hydroxycyclohexyl)oxyphenol?
The canonical SMILES for 3-(3-hydroxycyclohexyl)oxyphenol is Oc1cccc(OC2CCCC(O)C2)c1.
What is the InChIKey of 3-(3-hydroxycyclohexyl)oxyphenol?
The InChIKey is BZOBFYJOVXWZRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O3/c13-9-3-1-5-11(7-9)15-12-6-2-4-10(14)8-12/h1,3,5,7,10,12-14H,2,4,6,8H2.
What are the key properties of 3-(3-hydroxycyclohexyl)oxyphenol?
3-(3-hydroxycyclohexyl)oxyphenol has a molecular weight of 208.26 g/mol, XLogP of 2.07, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-hydroxycyclohexyl)oxyphenol is sourced from PubChem (CID 117095404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).