bis(4-ethenylcyclohexyl)methanol

C17H28O — CID 153439231

IUPACbis(4-ethenylcyclohexyl)methanol
SMILESC=CC1CCC(C(O)C2CCC(C=C)CC2)CC1
InChIInChI=1S/C17H28O/c1-3-13-5-9-15(10-6-13)17(18)16-11-7-14(4-2)8-12-16/h3-4,13-18H,1-2,5-12H2
InChIKeyLJUROLJNQFBHIG-UHFFFAOYSA-N
MW248.41 g/mol
LogP4.33
Rot. Bonds4

About bis(4-ethenylcyclohexyl)methanol

bis(4-ethenylcyclohexyl)methanol (PubChem CID 153439231) has the molecular formula C17H28O and a molecular weight of 248.41 g/mol. Its IUPAC name is bis(4-ethenylcyclohexyl)methanol.

Molecular Properties

Compound Namebis(4-ethenylcyclohexyl)methanol
PubChem CID153439231
Molecular FormulaC17H28O
Molecular Weight248.41 g/mol
Exact Mass248.21
IUPAC Namebis(4-ethenylcyclohexyl)methanol
SMILESC=CC1CCC(C(O)C2CCC(C=C)CC2)CC1
InChIInChI=1S/C17H28O/c1-3-13-5-9-15(10-6-13)17(18)16-11-7-14(4-2)8-12-16/h3-4,13-18H,1-2,5-12H2
InChIKeyLJUROLJNQFBHIG-UHFFFAOYSA-N
XLogP4.33
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.41
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(4-ethenylcyclohexyl)propan-1-ol
CID 141349608
1-ethenyl-4-[1-(4-ethenylcyclohexyl)ethyl]cyclohexane
CID 153439228
cyclooctyl(cyclopropyl)methanol
CID 80603317
4-(4-ethenylcyclohexyl)cyclohexan-1-ol
CID 129130656
4-ethenylcyclohexane-1-carbaldehyde
CID 15509286
4-ethenylcyclohexane-1-carboxylic acid
CID 18538169
ethenylcyclononane
CID 123465789
ethenylcyclotetradecane
CID 123915888
cyclopropyl(oxan-4-yl)methanol
CID 63936668
1-ethenyl-4-(4-ethenylcyclohexyl)oxycyclohexane
CID 148702983
1-(2,2-difluoroethyl)-4-(4-ethenylcyclohexyl)cyclohexane
CID 139748793
1-ethenyl-4-[4-(1-ethoxyethyl)cyclohexyl]cyclohexane
CID 91361324

Frequently Asked Questions

What is the IUPAC name of bis(4-ethenylcyclohexyl)methanol?
The IUPAC name of bis(4-ethenylcyclohexyl)methanol (CID 153439231) is bis(4-ethenylcyclohexyl)methanol.
What is the SMILES notation for bis(4-ethenylcyclohexyl)methanol?
The canonical SMILES for bis(4-ethenylcyclohexyl)methanol is C=CC1CCC(C(O)C2CCC(C=C)CC2)CC1.
What is the InChIKey of bis(4-ethenylcyclohexyl)methanol?
The InChIKey is LJUROLJNQFBHIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28O/c1-3-13-5-9-15(10-6-13)17(18)16-11-7-14(4-2)8-12-16/h3-4,13-18H,1-2,5-12H2.
What are the key properties of bis(4-ethenylcyclohexyl)methanol?
bis(4-ethenylcyclohexyl)methanol has a molecular weight of 248.41 g/mol, XLogP of 4.33, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-ethenylcyclohexyl)methanol is sourced from PubChem (CID 153439231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).