9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene

C14H20 — CID 15321172

IUPAC9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene
SMILESCc1c2ccc(c1C)CCCCCC2
InChIInChI=1S/C14H20/c1-11-12(2)14-8-6-4-3-5-7-13(11)9-10-14/h9-10H,3-8H2,1-2H3
InChIKeyARNPIKHROGGTJZ-UHFFFAOYSA-N
MW188.31 g/mol
LogP3.96
Rot. Bonds

About 9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene

9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene (PubChem CID 15321172) has the molecular formula C14H20 and a molecular weight of 188.31 g/mol. Its IUPAC name is 9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene.

Molecular Properties

Compound Name9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene
PubChem CID15321172
Molecular FormulaC14H20
Molecular Weight188.31 g/mol
Exact Mass188.16
IUPAC Name9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene
SMILESCc1c2ccc(c1C)CCCCCC2
InChIInChI=1S/C14H20/c1-11-12(2)14-8-6-4-3-5-7-13(11)9-10-14/h9-10H,3-8H2,1-2H3
InChIKeyARNPIKHROGGTJZ-UHFFFAOYSA-N
XLogP3.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 91587374
3,4-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulene;ethane
CID 91587373
ethane;6,7,8,9-tetrahydro-5H-benzo[7]annulene
CID 143018675
5,11-dibromo-6,12-dimethyltricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaene
CID 170660844
bicyclo[4.2.0]octa-1,3,5-triene;2,3-dihydro-1H-indene;5,6,7,8,9,10-hexahydrobenzo[8]annulene;6,7,8,9,10,11-hexahydro-5H-benzo[9]annulene;5,6,7,8,9,10,11,12-octahydrobenzo[10]annulene;6,7,8,9-tetrahydro-5H-benzo[7]annulene;1,2,3,4-tetrahydronaphthalene;1,2-xylene
CID 159244193
5-methyl-6-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 59613678
1-methyl-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
CID 22993784
1-hydroxy-2-methyl-5,6,7,8-tetrahydroquinolin-1-ium
CID 58485449
1,2,3,4-tetrahydronaphthalene
CID 174531863
ethane;methane;9-methyl-1,2,3,4,5,6,7,8-octahydroanthracene
CID 142513105
3-methyl-6,7,8,9,10,11-hexahydro-5H-cycloocta[a]indene
CID 53360534
2-(4-methylphenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyran-1-ium
CID 134911135

Frequently Asked Questions

What is the IUPAC name of 9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene?
The IUPAC name of 9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene (CID 15321172) is 9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene.
What is the SMILES notation for 9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene?
The canonical SMILES for 9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene is Cc1c2ccc(c1C)CCCCCC2.
What is the InChIKey of 9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene?
The InChIKey is ARNPIKHROGGTJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20/c1-11-12(2)14-8-6-4-3-5-7-13(11)9-10-14/h9-10H,3-8H2,1-2H3.
What are the key properties of 9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene?
9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene has a molecular weight of 188.31 g/mol, XLogP of 3.96, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-dimethylbicyclo[6.2.2]dodeca-1(10),8,11-triene is sourced from PubChem (CID 15321172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).