trimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane

C15H28Si2 — CID 101474513

IUPACtrimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane
SMILESC[Si](C)(C)[C@@H]1[C@H]2[C@@H]([C@H]1[Si](C)(C)C)[C@@H]1C=C[C@H]2C1
InChIInChI=1S/C15H28Si2/c1-16(2,3)14-12-10-7-8-11(9-10)13(12)15(14)17(4,5)6/h7-8,10-15H,9H2,1-6H3/t10-,11+,12+,13-,14-,15-/m1/s1
InChIKeyKYXODICYPBTKDB-YXJLRHLOSA-N
MW264.56 g/mol
LogP4.86
Rot. Bonds2

About trimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane

trimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane (PubChem CID 101474513) has the molecular formula C15H28Si2 and a molecular weight of 264.56 g/mol. Its IUPAC name is trimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane.

Molecular Properties

Compound Nametrimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane
PubChem CID101474513
Molecular FormulaC15H28Si2
Molecular Weight264.56 g/mol
Exact Mass264.17
IUPAC Nametrimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane
SMILESC[Si](C)(C)[C@@H]1[C@H]2[C@@H]([C@H]1[Si](C)(C)C)[C@@H]1C=C[C@H]2C1
InChIInChI=1S/C15H28Si2/c1-16(2,3)14-12-10-7-8-11(9-10)13(12)15(14)17(4,5)6/h7-8,10-15H,9H2,1-6H3/t10-,11+,12+,13-,14-,15-/m1/s1
InChIKeyKYXODICYPBTKDB-YXJLRHLOSA-N
XLogP4.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.56
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane?
The IUPAC name of trimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane (CID 101474513) is trimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane.
What is the SMILES notation for trimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane?
The canonical SMILES for trimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane is C[Si](C)(C)[C@@H]1[C@H]2[C@@H]([C@H]1[Si](C)(C)C)[C@@H]1C=C[C@H]2C1.
What is the InChIKey of trimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane?
The InChIKey is KYXODICYPBTKDB-YXJLRHLOSA-N. The full InChI is InChI=1S/C15H28Si2/c1-16(2,3)14-12-10-7-8-11(9-10)13(12)15(14)17(4,5)6/h7-8,10-15H,9H2,1-6H3/t10-,11+,12+,13-,14-,15-/m1/s1.
What are the key properties of trimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane?
trimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane has a molecular weight of 264.56 g/mol, XLogP of 4.86, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane is sourced from PubChem (CID 101474513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).