3-phenoxycyclohexan-1-ol

C12H16O2 — CID 79617811

IUPAC3-phenoxycyclohexan-1-ol
SMILESOC1CCCC(Oc2ccccc2)C1
InChIInChI=1S/C12H16O2/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-3,6-7,10,12-13H,4-5,8-9H2
InChIKeyTWHZCHQLTJEXDU-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.37
Rot. Bonds2

About 3-phenoxycyclohexan-1-ol

3-phenoxycyclohexan-1-ol (PubChem CID 79617811) has the molecular formula C12H16O2 and a molecular weight of 192.26 g/mol. Its IUPAC name is 3-phenoxycyclohexan-1-ol.

Molecular Properties

Compound Name3-phenoxycyclohexan-1-ol
PubChem CID79617811
Molecular FormulaC12H16O2
Molecular Weight192.26 g/mol
Exact Mass192.12
IUPAC Name3-phenoxycyclohexan-1-ol
SMILESOC1CCCC(Oc2ccccc2)C1
InChIInChI=1S/C12H16O2/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-3,6-7,10,12-13H,4-5,8-9H2
InChIKeyTWHZCHQLTJEXDU-UHFFFAOYSA-N
XLogP2.37
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-benzylphenoxy)cyclohexan-1-ol
CID 79599479
3-(4-chlorophenoxy)cyclohexan-1-ol
CID 123350797
3-(3-hydroxycyclohexyl)oxyphenol
CID 117095404
3-(4-pyridin-3-ylphenoxy)cyclohexan-1-ol
CID 117051625
3-(3-propan-2-ylphenoxy)cyclohexan-1-ol
CID 79618801
3-(3-hydroxycyclohexyl)oxybenzonitrile
CID 117052718
magnesium;cyclohexyloxybenzene;hydride
CID 174438663
N-methyl-3-phenoxycyclohexan-1-amine
CID 79618884
3-pyridin-2-yloxycyclohexan-1-ol
CID 117051379
4-(4-phenoxycyclohexylidene)cyclohexan-1-ol
CID 67824653
trans-(1R,3R)-3-phenylmethoxycyclohexan-1-ol
CID 14172790
2-(3-hydroxycyclohexyl)oxybenzonitrile
CID 117052783

Frequently Asked Questions

What is the IUPAC name of 3-phenoxycyclohexan-1-ol?
The IUPAC name of 3-phenoxycyclohexan-1-ol (CID 79617811) is 3-phenoxycyclohexan-1-ol.
What is the SMILES notation for 3-phenoxycyclohexan-1-ol?
The canonical SMILES for 3-phenoxycyclohexan-1-ol is OC1CCCC(Oc2ccccc2)C1.
What is the InChIKey of 3-phenoxycyclohexan-1-ol?
The InChIKey is TWHZCHQLTJEXDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O2/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-3,6-7,10,12-13H,4-5,8-9H2.
What are the key properties of 3-phenoxycyclohexan-1-ol?
3-phenoxycyclohexan-1-ol has a molecular weight of 192.26 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenoxycyclohexan-1-ol is sourced from PubChem (CID 79617811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).