8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene

C11H14 — CID 102064735

IUPAC8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene
SMILESCC1=C(C)C2C3CC4C(C13)C42
InChIInChI=1S/C11H14/c1-4-5(2)9-6-3-7-10(8(4)6)11(7)9/h6-11H,3H2,1-2H3
InChIKeyBVLNWQUHWKWWBJ-UHFFFAOYSA-N
MW146.23 g/mol
LogP2.46
Rot. Bonds

About 8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene

8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene (PubChem CID 102064735) has the molecular formula C11H14 and a molecular weight of 146.23 g/mol. Its IUPAC name is 8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene.

Molecular Properties

Compound Name8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene
PubChem CID102064735
Molecular FormulaC11H14
Molecular Weight146.23 g/mol
Exact Mass146.11
IUPAC Name8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene
SMILESCC1=C(C)C2C3CC4C(C13)C42
InChIInChI=1S/C11H14/c1-4-5(2)9-6-3-7-10(8(4)6)11(7)9/h6-11H,3H2,1-2H3
InChIKeyBVLNWQUHWKWWBJ-UHFFFAOYSA-N
XLogP2.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(1S,2S,3R,5S,6S,7S,9R,10S)-pentacyclo[5.4.0.02,6.03,10.05,9]undecane-8,11-dione
CID 124710529
(1R,4S,5R,7S,8S,13S,14R,16S)-heptacyclo[7.7.0.02,13.03,8.04,12.05,7.014,16]hexadecane-10,11-dione
CID 100896530
4,5,11,12-tetramethylhexacyclo[6.6.1.13,6.110,13.02,7.09,14]heptadecane
CID 23600006
4,5-dimethylpentacyclo[6.6.1.13,6.02,7.09,14]hexadec-4-ene
CID 141010985
(1S,2R,3S,5R,6S,7R,8S,9S,10R)-7-iodopentacyclo[6.3.0.02,6.03,10.05,9]undecan-4-one
CID 129463355
(1S,2S,3R,5S,6R,7R,8S,9R,10R)-7-bromopentacyclo[6.3.0.02,6.03,10.05,9]undecan-4-one
CID 99845185
(1S,2S,3R,5R,6R,7R,9R,10R)-pentacyclo[5.4.0.02,6.03,10.05,9]undecan-8-one
CID 124710584
5,6-dimethylpentacyclo[9.2.1.14,7.02,10.03,8]pentadeca-5,12-diene;yttrium
CID 161316254
2,3,7,8-tetramethyl-5-silaspiro[4.4]nona-2,7-diene
CID 13049558
diethyl (1S,4S,5S,8R,9S,10S,12S,13R)-3,6-dihydroxypentacyclo[6.5.0.04,12.05,10.09,13]trideca-2,6-diene-2,7-dicarboxylate
CID 98392308
(6R,9S,17S,20S)-nonacyclo[13.6.2.14,11.16,9.117,20.02,14.03,12.05,10.016,21]hexacosan-13-one
CID 50908923
(1S,2R,3R,4R,6S,7R)-8-(2-methoxyethyl)tetracyclo[4.3.0.02,4.03,7]non-8-ene
CID 10012452

Frequently Asked Questions

What is the IUPAC name of 8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene?
The IUPAC name of 8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene (CID 102064735) is 8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene.
What is the SMILES notation for 8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene?
The canonical SMILES for 8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene is CC1=C(C)C2C3CC4C(C13)C42.
What is the InChIKey of 8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene?
The InChIKey is BVLNWQUHWKWWBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14/c1-4-5(2)9-6-3-7-10(8(4)6)11(7)9/h6-11H,3H2,1-2H3.
What are the key properties of 8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene?
8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene has a molecular weight of 146.23 g/mol, XLogP of 2.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8,9-dimethyltetracyclo[4.3.0.02,4.03,7]non-8-ene is sourced from PubChem (CID 102064735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).