(1S,4R)-4-phenoxycyclohex-2-en-1-ol

C12H14O2 — CID 11063214

IUPAC(1S,4R)-4-phenoxycyclohex-2-en-1-ol
SMILESO[C@@H]1C=C[C@H](Oc2ccccc2)CC1
InChIInChI=1S/C12H14O2/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-6,8,10,12-13H,7,9H2/t10-,12+/m1/s1
InChIKeyMAXUEEGAHRLECG-PWSUYJOCSA-N
MW190.24 g/mol
LogP2.14
Rot. Bonds2

About (1S,4R)-4-phenoxycyclohex-2-en-1-ol

(1S,4R)-4-phenoxycyclohex-2-en-1-ol (PubChem CID 11063214) has the molecular formula C12H14O2 and a molecular weight of 190.24 g/mol. Its IUPAC name is (1S,4R)-4-phenoxycyclohex-2-en-1-ol.

Molecular Properties

Compound Name(1S,4R)-4-phenoxycyclohex-2-en-1-ol
PubChem CID11063214
Molecular FormulaC12H14O2
Molecular Weight190.24 g/mol
Exact Mass190.10
IUPAC Name(1S,4R)-4-phenoxycyclohex-2-en-1-ol
SMILESO[C@@H]1C=C[C@H](Oc2ccccc2)CC1
InChIInChI=1S/C12H14O2/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-6,8,10,12-13H,7,9H2/t10-,12+/m1/s1
InChIKeyMAXUEEGAHRLECG-PWSUYJOCSA-N
XLogP2.14
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(4-methylcyclohex-2-en-1-yl)oxybenzene
CID 54323579
[(1R)-cyclopent-2-en-1-yl]oxybenzene
CID 135011390
(1R,4R)-4-trityloxycyclopent-2-en-1-ol
CID 11121433
trans-(1S,2S)-2-(4-phenoxyphenoxy)cyclopentan-1-ol
CID 102735416
2-phenoxycyclooctan-1-ol
CID 22247671
benzene-1,4-diol;cyclohex-2-ene-1,4-diol
CID 159375181
3-phenoxycyclohexan-1-ol
CID 79617811
4-(4-phenoxycyclohexylidene)cyclohexan-1-ol
CID 67824653
2-phenoxycyclobutan-1-one
CID 12791410
4-(4-hydroxycyclohexyl)oxycyclohex-2-en-1-ol
CID 154518927
(2R)-2-phenoxyoxolane-3,4-diol
CID 18658260
1-cyclohexyloxy-4-phenoxybenzene
CID 70600234

Frequently Asked Questions

What is the IUPAC name of (1S,4R)-4-phenoxycyclohex-2-en-1-ol?
The IUPAC name of (1S,4R)-4-phenoxycyclohex-2-en-1-ol (CID 11063214) is (1S,4R)-4-phenoxycyclohex-2-en-1-ol.
What is the SMILES notation for (1S,4R)-4-phenoxycyclohex-2-en-1-ol?
The canonical SMILES for (1S,4R)-4-phenoxycyclohex-2-en-1-ol is O[C@@H]1C=C[C@H](Oc2ccccc2)CC1.
What is the InChIKey of (1S,4R)-4-phenoxycyclohex-2-en-1-ol?
The InChIKey is MAXUEEGAHRLECG-PWSUYJOCSA-N. The full InChI is InChI=1S/C12H14O2/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-6,8,10,12-13H,7,9H2/t10-,12+/m1/s1.
What are the key properties of (1S,4R)-4-phenoxycyclohex-2-en-1-ol?
(1S,4R)-4-phenoxycyclohex-2-en-1-ol has a molecular weight of 190.24 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,4R)-4-phenoxycyclohex-2-en-1-ol is sourced from PubChem (CID 11063214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).