4-(4-cyclohexylcyclohexen-1-yl)phenol

C18H24O — CID 139920230

IUPAC4-(4-cyclohexylcyclohexen-1-yl)phenol
SMILESOc1ccc(C2=CCC(C3CCCCC3)CC2)cc1
InChIInChI=1S/C18H24O/c19-18-12-10-17(11-13-18)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h8,10-15,19H,1-7,9H2
InChIKeyVTRZMCIELDPBMV-UHFFFAOYSA-N
MW256.39 g/mol
LogP5.16
Rot. Bonds2

About 4-(4-cyclohexylcyclohexen-1-yl)phenol

4-(4-cyclohexylcyclohexen-1-yl)phenol (PubChem CID 139920230) has the molecular formula C18H24O and a molecular weight of 256.39 g/mol. Its IUPAC name is 4-(4-cyclohexylcyclohexen-1-yl)phenol.

Molecular Properties

Compound Name4-(4-cyclohexylcyclohexen-1-yl)phenol
PubChem CID139920230
Molecular FormulaC18H24O
Molecular Weight256.39 g/mol
Exact Mass256.18
IUPAC Name4-(4-cyclohexylcyclohexen-1-yl)phenol
SMILESOc1ccc(C2=CCC(C3CCCCC3)CC2)cc1
InChIInChI=1S/C18H24O/c19-18-12-10-17(11-13-18)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h8,10-15,19H,1-7,9H2
InChIKeyVTRZMCIELDPBMV-UHFFFAOYSA-N
XLogP5.16
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500256.39
LogP ≤ 55.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(4-cyclohexylcyclohexen-1-yl)phenol?
The IUPAC name of 4-(4-cyclohexylcyclohexen-1-yl)phenol (CID 139920230) is 4-(4-cyclohexylcyclohexen-1-yl)phenol.
What is the SMILES notation for 4-(4-cyclohexylcyclohexen-1-yl)phenol?
The canonical SMILES for 4-(4-cyclohexylcyclohexen-1-yl)phenol is Oc1ccc(C2=CCC(C3CCCCC3)CC2)cc1.
What is the InChIKey of 4-(4-cyclohexylcyclohexen-1-yl)phenol?
The InChIKey is VTRZMCIELDPBMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24O/c19-18-12-10-17(11-13-18)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h8,10-15,19H,1-7,9H2.
What are the key properties of 4-(4-cyclohexylcyclohexen-1-yl)phenol?
4-(4-cyclohexylcyclohexen-1-yl)phenol has a molecular weight of 256.39 g/mol, XLogP of 5.16, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyclohexylcyclohexen-1-yl)phenol is sourced from PubChem (CID 139920230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).