trimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane

C11H22O3Si — CID 58214795

IUPACtrimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane
SMILESCO[Si](OC)(OC)[C@H]1C[C@H]2C[C@@H]1C[C@H]2C
InChIInChI=1S/C11H22O3Si/c1-8-5-10-6-9(8)7-11(10)15(12-2,13-3)14-4/h8-11H,5-7H2,1-4H3/t8-,9-,10+,11+/m1/s1
InChIKeyCCDDMPMGWOMMEY-ZNSHCXBVSA-N
MW230.38 g/mol
LogP2.30
Rot. Bonds4

About trimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane

trimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane (PubChem CID 58214795) has the molecular formula C11H22O3Si and a molecular weight of 230.38 g/mol. Its IUPAC name is trimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane.

Molecular Properties

Compound Nametrimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane
PubChem CID58214795
Molecular FormulaC11H22O3Si
Molecular Weight230.38 g/mol
Exact Mass230.13
IUPAC Nametrimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane
SMILESCO[Si](OC)(OC)[C@H]1C[C@H]2C[C@@H]1C[C@H]2C
InChIInChI=1S/C11H22O3Si/c1-8-5-10-6-9(8)7-11(10)15(12-2,13-3)14-4/h8-11H,5-7H2,1-4H3/t8-,9-,10+,11+/m1/s1
InChIKeyCCDDMPMGWOMMEY-ZNSHCXBVSA-N
XLogP2.30
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane?
The IUPAC name of trimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane (CID 58214795) is trimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane.
What is the SMILES notation for trimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane?
The canonical SMILES for trimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane is CO[Si](OC)(OC)[C@H]1C[C@H]2C[C@@H]1C[C@H]2C.
What is the InChIKey of trimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane?
The InChIKey is CCDDMPMGWOMMEY-ZNSHCXBVSA-N. The full InChI is InChI=1S/C11H22O3Si/c1-8-5-10-6-9(8)7-11(10)15(12-2,13-3)14-4/h8-11H,5-7H2,1-4H3/t8-,9-,10+,11+/m1/s1.
What are the key properties of trimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane?
trimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane has a molecular weight of 230.38 g/mol, XLogP of 2.30, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy-[(1S,2S,4R,5R)-5-methyl-2-bicyclo[2.2.1]heptanyl]silane is sourced from PubChem (CID 58214795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).