bis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate

C18H28O4Si2 — CID 124783515

IUPACbis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate
SMILESC[Si](C)(C)OC(=O)[C@@H]1[C@H]2C=C[C@@H]([C@@H]3C=C[C@H]32)[C@H]1C(=O)O[Si](C)(C)C
InChIInChI=1S/C18H28O4Si2/c1-23(2,3)21-17(19)15-13-9-10-14(12-8-7-11(12)13)16(15)18(20)22-24(4,5)6/h7-16H,1-6H3/t11-,12-,13+,14+,15-,16-/m1/s1
InChIKeyQEWRIHXEVMMUJR-OWDFPOFWSA-N
MW364.59 g/mol
LogP3.59
Rot. Bonds4

About bis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate

bis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate (PubChem CID 124783515) has the molecular formula C18H28O4Si2 and a molecular weight of 364.59 g/mol. Its IUPAC name is bis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate.

Molecular Properties

Compound Namebis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate
PubChem CID124783515
Molecular FormulaC18H28O4Si2
Molecular Weight364.59 g/mol
Exact Mass364.15
IUPAC Namebis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate
SMILESC[Si](C)(C)OC(=O)[C@@H]1[C@H]2C=C[C@@H]([C@@H]3C=C[C@H]32)[C@H]1C(=O)O[Si](C)(C)C
InChIInChI=1S/C18H28O4Si2/c1-23(2,3)21-17(19)15-13-9-10-14(12-8-7-11(12)13)16(15)18(20)22-24(4,5)6/h7-16H,1-6H3/t11-,12-,13+,14+,15-,16-/m1/s1
InChIKeyQEWRIHXEVMMUJR-OWDFPOFWSA-N
XLogP3.59
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.59
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze bis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of bis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate?
The IUPAC name of bis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate (CID 124783515) is bis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate.
What is the SMILES notation for bis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate?
The canonical SMILES for bis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate is C[Si](C)(C)OC(=O)[C@@H]1[C@H]2C=C[C@@H]([C@@H]3C=C[C@H]32)[C@H]1C(=O)O[Si](C)(C)C.
What is the InChIKey of bis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate?
The InChIKey is QEWRIHXEVMMUJR-OWDFPOFWSA-N. The full InChI is InChI=1S/C18H28O4Si2/c1-23(2,3)21-17(19)15-13-9-10-14(12-8-7-11(12)13)16(15)18(20)22-24(4,5)6/h7-16H,1-6H3/t11-,12-,13+,14+,15-,16-/m1/s1.
What are the key properties of bis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate?
bis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate has a molecular weight of 364.59 g/mol, XLogP of 3.59, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylsilyl) (1S,2R,5R,6S,7R,8R)-tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboxylate is sourced from PubChem (CID 124783515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).