7-methyltricyclo[3.3.1.03,9]non-1(8)-ene

C10H14 — CID 91441468

IUPAC7-methyltricyclo[3.3.1.03,9]non-1(8)-ene
SMILESCC1C=C2CC3CC(C1)C23
InChIInChI=1S/C10H14/c1-6-2-7-4-9-5-8(3-6)10(7)9/h2,6,8-10H,3-5H2,1H3
InChIKeyDXQSARJFRXXSTN-UHFFFAOYSA-N
MW134.22 g/mol
LogP2.61
Rot. Bonds

About 7-methyltricyclo[3.3.1.03,9]non-1(8)-ene

7-methyltricyclo[3.3.1.03,9]non-1(8)-ene (PubChem CID 91441468) has the molecular formula C10H14 and a molecular weight of 134.22 g/mol. Its IUPAC name is 7-methyltricyclo[3.3.1.03,9]non-1(8)-ene.

Molecular Properties

Compound Name7-methyltricyclo[3.3.1.03,9]non-1(8)-ene
PubChem CID91441468
Molecular FormulaC10H14
Molecular Weight134.22 g/mol
Exact Mass134.11
IUPAC Name7-methyltricyclo[3.3.1.03,9]non-1(8)-ene
SMILESCC1C=C2CC3CC(C1)C23
InChIInChI=1S/C10H14/c1-6-2-7-4-9-5-8(3-6)10(7)9/h2,6,8-10H,3-5H2,1H3
InChIKeyDXQSARJFRXXSTN-UHFFFAOYSA-N
XLogP2.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.22
LogP ≤ 52.61
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 7-methyltricyclo[3.3.1.03,9]non-1(8)-ene?
The IUPAC name of 7-methyltricyclo[3.3.1.03,9]non-1(8)-ene (CID 91441468) is 7-methyltricyclo[3.3.1.03,9]non-1(8)-ene.
What is the SMILES notation for 7-methyltricyclo[3.3.1.03,9]non-1(8)-ene?
The canonical SMILES for 7-methyltricyclo[3.3.1.03,9]non-1(8)-ene is CC1C=C2CC3CC(C1)C23.
What is the InChIKey of 7-methyltricyclo[3.3.1.03,9]non-1(8)-ene?
The InChIKey is DXQSARJFRXXSTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14/c1-6-2-7-4-9-5-8(3-6)10(7)9/h2,6,8-10H,3-5H2,1H3.
What are the key properties of 7-methyltricyclo[3.3.1.03,9]non-1(8)-ene?
7-methyltricyclo[3.3.1.03,9]non-1(8)-ene has a molecular weight of 134.22 g/mol, XLogP of 2.61, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyltricyclo[3.3.1.03,9]non-1(8)-ene is sourced from PubChem (CID 91441468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).