undec-10-enyl 2-trimethylsilylacetate

C16H32O2Si — CID 88523333

IUPACundec-10-enyl 2-trimethylsilylacetate
SMILESC=CCCCCCCCCCOC(=O)C[Si](C)(C)C
InChIInChI=1S/C16H32O2Si/c1-5-6-7-8-9-10-11-12-13-14-18-16(17)15-19(2,3)4/h5H,1,6-15H2,2-4H3
InChIKeyJJBQWZWQGUCFOE-UHFFFAOYSA-N
MW284.52 g/mol
LogP5.17
Rot. Bonds12

About undec-10-enyl 2-trimethylsilylacetate

undec-10-enyl 2-trimethylsilylacetate (PubChem CID 88523333) has the molecular formula C16H32O2Si and a molecular weight of 284.52 g/mol. Its IUPAC name is undec-10-enyl 2-trimethylsilylacetate.

Molecular Properties

Compound Nameundec-10-enyl 2-trimethylsilylacetate
PubChem CID88523333
Molecular FormulaC16H32O2Si
Molecular Weight284.52 g/mol
Exact Mass284.22
IUPAC Nameundec-10-enyl 2-trimethylsilylacetate
SMILESC=CCCCCCCCCCOC(=O)C[Si](C)(C)C
InChIInChI=1S/C16H32O2Si/c1-5-6-7-8-9-10-11-12-13-14-18-16(17)15-19(2,3)4/h5H,1,6-15H2,2-4H3
InChIKeyJJBQWZWQGUCFOE-UHFFFAOYSA-N
XLogP5.17
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.52
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 undec-10-enyl 2-trimethylsilylacetate?
The IUPAC name of undec-10-enyl 2-trimethylsilylacetate (CID 88523333) is undec-10-enyl 2-trimethylsilylacetate.
What is the SMILES notation for undec-10-enyl 2-trimethylsilylacetate?
The canonical SMILES for undec-10-enyl 2-trimethylsilylacetate is C=CCCCCCCCCCOC(=O)C[Si](C)(C)C.
What is the InChIKey of undec-10-enyl 2-trimethylsilylacetate?
The InChIKey is JJBQWZWQGUCFOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O2Si/c1-5-6-7-8-9-10-11-12-13-14-18-16(17)15-19(2,3)4/h5H,1,6-15H2,2-4H3.
What are the key properties of undec-10-enyl 2-trimethylsilylacetate?
undec-10-enyl 2-trimethylsilylacetate has a molecular weight of 284.52 g/mol, XLogP of 5.17, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for undec-10-enyl 2-trimethylsilylacetate is sourced from PubChem (CID 88523333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).