trimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane

C14H18Sn — CID 71544932

IUPACtrimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane
SMILESC[Sn](C)(C)C1[C@@H]2C=C[C@H]1c1ccccc12
InChIInChI=1S/C11H9.3CH3.Sn/c1-2-4-11-9-6-5-8(7-9)10(11)3-1;;;;/h1-9H;3*1H3;/t8-,9+;;;;
InChIKeyRQIUHYAVAXBGQZ-ZNPOZJMQSA-N
MW305.01 g/mol
LogP4.15
Rot. Bonds1

About trimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane

trimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane (PubChem CID 71544932) has the molecular formula C14H18Sn and a molecular weight of 305.01 g/mol. Its IUPAC name is trimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane.

Molecular Properties

Compound Nametrimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane
PubChem CID71544932
Molecular FormulaC14H18Sn
Molecular Weight305.01 g/mol
Exact Mass306.04
IUPAC Nametrimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane
SMILESC[Sn](C)(C)C1[C@@H]2C=C[C@H]1c1ccccc12
InChIInChI=1S/C11H9.3CH3.Sn/c1-2-4-11-9-6-5-8(7-9)10(11)3-1;;;;/h1-9H;3*1H3;/t8-,9+;;;;
InChIKeyRQIUHYAVAXBGQZ-ZNPOZJMQSA-N
XLogP4.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.01
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze trimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tricyclo[7.2.1.02,7]dodeca-2,4,6,10-tetraene-8,12-diol
CID 130147962
11,11-dimethyl-10,12-dioxatetracyclo[6.5.2.02,7.09,13]pentadeca-2,4,6,14-tetraene
CID 58427899
(1R,8R,9S,12S)-10-methyltetracyclo[6.4.2.02,7.09,12]tetradeca-2,4,6,10,13-pentaene
CID 124910661
1,4-dimethyl-1,4-dihydronaphthalene
CID 13283200
(1S,8R,9R,11S)-tetracyclo[6.3.2.02,7.09,11]trideca-2,4,6,12-tetraene-10-carbaldehyde
CID 11830355
(1S,8S,9S,12R)-10-azatetracyclo[6.4.2.29,12.02,7]hexadeca-2,4,6,13,15-pentaen-11-one
CID 10846733
(1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol
CID 10535021
heptacyclo[16.6.0.02,9.03,8.010,17.011,16.019,24]tetracosa-3,5,7,11,13,15,19,21,23-nonaene
CID 101073246
7,8-dimethylbicyclo[4.2.0]octa-1,3,5-triene;ethane
CID 159809006
(11R)-11-chloro-12-nitrosotricyclo[6.2.2.02,7]dodeca-2,4,6,9-tetraene
CID 5314116
trimethyl-[(5R,6R,11S,12S)-6,11,12-tris(trimethylsilyl)-5,6,11,12-tetrahydrotetracen-5-yl]silane
CID 132992519
8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol
CID 12561909

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane?
The IUPAC name of trimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane (CID 71544932) is trimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane.
What is the SMILES notation for trimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane?
The canonical SMILES for trimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane is C[Sn](C)(C)C1[C@@H]2C=C[C@H]1c1ccccc12.
What is the InChIKey of trimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane?
The InChIKey is RQIUHYAVAXBGQZ-ZNPOZJMQSA-N. The full InChI is InChI=1S/C11H9.3CH3.Sn/c1-2-4-11-9-6-5-8(7-9)10(11)3-1;;;;/h1-9H;3*1H3;/t8-,9+;;;;.
What are the key properties of trimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane?
trimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane has a molecular weight of 305.01 g/mol, XLogP of 4.15, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(1S,8R)-11-tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraenyl]stannane is sourced from PubChem (CID 71544932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).