2-bicyclo[3.2.0]hept-1(5)-enylmethanol

C8H12O — CID 130331549

IUPAC2-bicyclo[3.2.0]hept-1(5)-enylmethanol
SMILESOCC1CCC2=C1CC2
InChIInChI=1S/C8H12O/c9-5-7-2-1-6-3-4-8(6)7/h7,9H,1-5H2
InChIKeyYUXGASAFEMCYRM-UHFFFAOYSA-N
MW124.18 g/mol
LogP1.48
Rot. Bonds1

About 2-bicyclo[3.2.0]hept-1(5)-enylmethanol

2-bicyclo[3.2.0]hept-1(5)-enylmethanol (PubChem CID 130331549) has the molecular formula C8H12O and a molecular weight of 124.18 g/mol. Its IUPAC name is 2-bicyclo[3.2.0]hept-1(5)-enylmethanol.

Molecular Properties

Compound Name2-bicyclo[3.2.0]hept-1(5)-enylmethanol
PubChem CID130331549
Molecular FormulaC8H12O
Molecular Weight124.18 g/mol
Exact Mass124.09
IUPAC Name2-bicyclo[3.2.0]hept-1(5)-enylmethanol
SMILESOCC1CCC2=C1CC2
InChIInChI=1S/C8H12O/c9-5-7-2-1-6-3-4-8(6)7/h7,9H,1-5H2
InChIKeyYUXGASAFEMCYRM-UHFFFAOYSA-N
XLogP1.48
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.18
LogP ≤ 51.48
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

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2-(hydroxymethyl)cycloheptan-1-one
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ethane;2-(hydroxymethyl)cyclopentan-1-one
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[4-(hydroxymethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]methanol
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3-(hydroxymethyl)-2-methylidenecyclopentan-1-ol
CID 141212143
[4-(hydroxymethyl)-1,2,3,4,5,6-hexahydrocyclopenta[c]pyrrol-6-yl]methanol
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2-cyclopropylidenecyclohexan-1-ol
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Frequently Asked Questions

What is the IUPAC name of 2-bicyclo[3.2.0]hept-1(5)-enylmethanol?
The IUPAC name of 2-bicyclo[3.2.0]hept-1(5)-enylmethanol (CID 130331549) is 2-bicyclo[3.2.0]hept-1(5)-enylmethanol.
What is the SMILES notation for 2-bicyclo[3.2.0]hept-1(5)-enylmethanol?
The canonical SMILES for 2-bicyclo[3.2.0]hept-1(5)-enylmethanol is OCC1CCC2=C1CC2.
What is the InChIKey of 2-bicyclo[3.2.0]hept-1(5)-enylmethanol?
The InChIKey is YUXGASAFEMCYRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12O/c9-5-7-2-1-6-3-4-8(6)7/h7,9H,1-5H2.
What are the key properties of 2-bicyclo[3.2.0]hept-1(5)-enylmethanol?
2-bicyclo[3.2.0]hept-1(5)-enylmethanol has a molecular weight of 124.18 g/mol, XLogP of 1.48, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bicyclo[3.2.0]hept-1(5)-enylmethanol is sourced from PubChem (CID 130331549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).