tricyclo[6.2.0.03,6]deca-1(8),3(6)-diene

C10H12 — CID 2752902

IUPACtricyclo[6.2.0.03,6]deca-1(8),3(6)-diene
SMILESC1CC2=C1CC1=C(CC1)C2
InChIInChI=1S/C10H12/c1-2-8-6-10-4-3-9(10)5-7(1)8/h1-6H2
InChIKeyCDFSMHKHGXCGNB-UHFFFAOYSA-N
MW132.21 g/mol
LogP2.96
Rot. Bonds

About tricyclo[6.2.0.03,6]deca-1(8),3(6)-diene

tricyclo[6.2.0.03,6]deca-1(8),3(6)-diene (PubChem CID 2752902) has the molecular formula C10H12 and a molecular weight of 132.21 g/mol. Its IUPAC name is tricyclo[6.2.0.03,6]deca-1(8),3(6)-diene.

Molecular Properties

Compound Nametricyclo[6.2.0.03,6]deca-1(8),3(6)-diene
PubChem CID2752902
Molecular FormulaC10H12
Molecular Weight132.21 g/mol
Exact Mass132.09
IUPAC Nametricyclo[6.2.0.03,6]deca-1(8),3(6)-diene
SMILESC1CC2=C1CC1=C(CC1)C2
InChIInChI=1S/C10H12/c1-2-8-6-10-4-3-9(10)5-7(1)8/h1-6H2
InChIKeyCDFSMHKHGXCGNB-UHFFFAOYSA-N
XLogP2.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.21
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 tricyclo[6.2.0.03,6]deca-1(8),3(6)-diene?
The IUPAC name of tricyclo[6.2.0.03,6]deca-1(8),3(6)-diene (CID 2752902) is tricyclo[6.2.0.03,6]deca-1(8),3(6)-diene.
What is the SMILES notation for tricyclo[6.2.0.03,6]deca-1(8),3(6)-diene?
The canonical SMILES for tricyclo[6.2.0.03,6]deca-1(8),3(6)-diene is C1CC2=C1CC1=C(CC1)C2.
What is the InChIKey of tricyclo[6.2.0.03,6]deca-1(8),3(6)-diene?
The InChIKey is CDFSMHKHGXCGNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12/c1-2-8-6-10-4-3-9(10)5-7(1)8/h1-6H2.
What are the key properties of tricyclo[6.2.0.03,6]deca-1(8),3(6)-diene?
tricyclo[6.2.0.03,6]deca-1(8),3(6)-diene has a molecular weight of 132.21 g/mol, XLogP of 2.96, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tricyclo[6.2.0.03,6]deca-1(8),3(6)-diene is sourced from PubChem (CID 2752902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).