1-adamantyl-dec-1-enyl-dimethylsilane

C22H40Si — CID 139918446

IUPAC1-adamantyl-dec-1-enyl-dimethylsilane
SMILESCCCCCCCCC=C[Si](C)(C)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C22H40Si/c1-4-5-6-7-8-9-10-11-12-23(2,3)22-16-19-13-20(17-22)15-21(14-19)18-22/h11-12,19-21H,4-10,13-18H2,1-3H3
InChIKeyIUKZGSKEHYGFKC-UHFFFAOYSA-N
MW332.65 g/mol
LogP7.51
Rot. Bonds9

About 1-adamantyl-dec-1-enyl-dimethylsilane

1-adamantyl-dec-1-enyl-dimethylsilane (PubChem CID 139918446) has the molecular formula C22H40Si and a molecular weight of 332.65 g/mol. Its IUPAC name is 1-adamantyl-dec-1-enyl-dimethylsilane.

Molecular Properties

Compound Name1-adamantyl-dec-1-enyl-dimethylsilane
PubChem CID139918446
Molecular FormulaC22H40Si
Molecular Weight332.65 g/mol
Exact Mass332.29
IUPAC Name1-adamantyl-dec-1-enyl-dimethylsilane
SMILESCCCCCCCCC=C[Si](C)(C)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C22H40Si/c1-4-5-6-7-8-9-10-11-12-23(2,3)22-16-19-13-20(17-22)15-21(14-19)18-22/h11-12,19-21H,4-10,13-18H2,1-3H3
InChIKeyIUKZGSKEHYGFKC-UHFFFAOYSA-N
XLogP7.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.65
LogP ≤ 57.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-adamantyl-dec-1-enyl-dimethylsilane?
The IUPAC name of 1-adamantyl-dec-1-enyl-dimethylsilane (CID 139918446) is 1-adamantyl-dec-1-enyl-dimethylsilane.
What is the SMILES notation for 1-adamantyl-dec-1-enyl-dimethylsilane?
The canonical SMILES for 1-adamantyl-dec-1-enyl-dimethylsilane is CCCCCCCCC=C[Si](C)(C)C12CC3CC(CC(C3)C1)C2.
What is the InChIKey of 1-adamantyl-dec-1-enyl-dimethylsilane?
The InChIKey is IUKZGSKEHYGFKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H40Si/c1-4-5-6-7-8-9-10-11-12-23(2,3)22-16-19-13-20(17-22)15-21(14-19)18-22/h11-12,19-21H,4-10,13-18H2,1-3H3.
What are the key properties of 1-adamantyl-dec-1-enyl-dimethylsilane?
1-adamantyl-dec-1-enyl-dimethylsilane has a molecular weight of 332.65 g/mol, XLogP of 7.51, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-adamantyl-dec-1-enyl-dimethylsilane is sourced from PubChem (CID 139918446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).