11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol

C15H24O — CID 91715484

IUPAC11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol
SMILESC=C1CCCC(=C)C2CC(C)(C)C2CC1O
InChIInChI=1S/C15H24O/c1-10-6-5-7-11(2)14(16)8-13-12(10)9-15(13,3)4/h12-14,16H,1-2,5-9H2,3-4H3
InChIKeyQQSSOERUYIHBRS-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.70
Rot. Bonds

About 11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol

11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol (PubChem CID 91715484) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol.

Molecular Properties

Compound Name11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol
PubChem CID91715484
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol
SMILESC=C1CCCC(=C)C2CC(C)(C)C2CC1O
InChIInChI=1S/C15H24O/c1-10-6-5-7-11(2)14(16)8-13-12(10)9-15(13,3)4/h12-14,16H,1-2,5-9H2,3-4H3
InChIKeyQQSSOERUYIHBRS-UHFFFAOYSA-N
XLogP3.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol?
The IUPAC name of 11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol (CID 91715484) is 11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol.
What is the SMILES notation for 11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol?
The canonical SMILES for 11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol is C=C1CCCC(=C)C2CC(C)(C)C2CC1O.
What is the InChIKey of 11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol?
The InChIKey is QQSSOERUYIHBRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-10-6-5-7-11(2)14(16)8-13-12(10)9-15(13,3)4/h12-14,16H,1-2,5-9H2,3-4H3.
What are the key properties of 11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol?
11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol has a molecular weight of 220.36 g/mol, XLogP of 3.70, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecan-3-ol is sourced from PubChem (CID 91715484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).