3-methylidenebicyclo[3.2.0]heptan-6-ol

C8H12O — CID 163569248

IUPAC3-methylidenebicyclo[3.2.0]heptan-6-ol
SMILESC=C1CC2CC(O)C2C1
InChIInChI=1S/C8H12O/c1-5-2-6-4-8(9)7(6)3-5/h6-9H,1-4H2
InChIKeyFXVGODKEUVPJJB-UHFFFAOYSA-N
MW124.18 g/mol
LogP1.33
Rot. Bonds

About 3-methylidenebicyclo[3.2.0]heptan-6-ol

3-methylidenebicyclo[3.2.0]heptan-6-ol (PubChem CID 163569248) has the molecular formula C8H12O and a molecular weight of 124.18 g/mol. Its IUPAC name is 3-methylidenebicyclo[3.2.0]heptan-6-ol.

Molecular Properties

Compound Name3-methylidenebicyclo[3.2.0]heptan-6-ol
PubChem CID163569248
Molecular FormulaC8H12O
Molecular Weight124.18 g/mol
Exact Mass124.09
IUPAC Name3-methylidenebicyclo[3.2.0]heptan-6-ol
SMILESC=C1CC2CC(O)C2C1
InChIInChI=1S/C8H12O/c1-5-2-6-4-8(9)7(6)3-5/h6-9H,1-4H2
InChIKeyFXVGODKEUVPJJB-UHFFFAOYSA-N
XLogP1.33
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.18
LogP ≤ 51.33
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

(3aS,4S,7aR)-2-methylidene-1,3,3a,4,5,6,7,7a-octahydroinden-4-ol
CID 130977949
(1R,2R,3aS,6aR)-1-[(3S)-3-hydroxyoct-1-enyl]-5-methylidene-2,3,3a,4,6,6a-hexahydro-1H-pentalen-2-ol
CID 57059927
(1R,2R,3aS,6aR)-1-(4-hydroxyoct-1-enyl)-5-methylidene-2,3,3a,4,6,6a-hexahydro-1H-pentalen-2-ol
CID 67684153
(3aS,6aR)-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]furan
CID 139878669
(1R,2R,3aS,6aR)-1-[(3S)-3-ethenyl-3-hydroxyoct-1-enyl]-5-methylidene-2,3,3a,4,6,6a-hexahydro-1H-pentalen-2-ol
CID 57089369
(3aR,6aS)-5-methylidene-2,3,3a,4,6,6a-hexahydro-1H-pentalene
CID 13462494
(1R,2R,4S,5S,6R)-tricyclo[3.2.1.02,4]octan-6-ol
CID 124536655
(1R,2S,3S,7R,8S,9S,13R)-7-(hydroxymethyl)-5,11-dimethylidenetricyclo[7.3.1.02,8]tridecane-3,13-diol
CID 102007080
8-methyl-3-methylidene-8-azabicyclo[3.2.1]octan-6-ol
CID 58902791
(3R,4S)-tricyclo[4.2.1.03,7]nonan-4-ol
CID 12649513
(3aR,6aS)-5-methylidene-2,3,3a,4,6,6a-hexahydro-1H-pentalen-2-ide;bis(yttrium)
CID 162412287
bicyclo[2.2.1]heptane-2,5,7-triol
CID 22290058

Frequently Asked Questions

What is the IUPAC name of 3-methylidenebicyclo[3.2.0]heptan-6-ol?
The IUPAC name of 3-methylidenebicyclo[3.2.0]heptan-6-ol (CID 163569248) is 3-methylidenebicyclo[3.2.0]heptan-6-ol.
What is the SMILES notation for 3-methylidenebicyclo[3.2.0]heptan-6-ol?
The canonical SMILES for 3-methylidenebicyclo[3.2.0]heptan-6-ol is C=C1CC2CC(O)C2C1.
What is the InChIKey of 3-methylidenebicyclo[3.2.0]heptan-6-ol?
The InChIKey is FXVGODKEUVPJJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12O/c1-5-2-6-4-8(9)7(6)3-5/h6-9H,1-4H2.
What are the key properties of 3-methylidenebicyclo[3.2.0]heptan-6-ol?
3-methylidenebicyclo[3.2.0]heptan-6-ol has a molecular weight of 124.18 g/mol, XLogP of 1.33, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidenebicyclo[3.2.0]heptan-6-ol is sourced from PubChem (CID 163569248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).