ethyl (2E)-2-(trimethylsilylmethylidene)decanoate

C16H32O2Si — CID 10968059

IUPACethyl (2E)-2-(trimethylsilylmethylidene)decanoate
SMILESCCCCCCCC/C(=C\[Si](C)(C)C)C(=O)OCC
InChIInChI=1S/C16H32O2Si/c1-6-8-9-10-11-12-13-15(14-19(3,4)5)16(17)18-7-2/h14H,6-13H2,1-5H3/b15-14+
InChIKeyONUZDQSWRGTQHZ-CCEZHUSRSA-N
MW284.52 g/mol
LogP5.10
Rot. Bonds10

About ethyl (2E)-2-(trimethylsilylmethylidene)decanoate

ethyl (2E)-2-(trimethylsilylmethylidene)decanoate (PubChem CID 10968059) has the molecular formula C16H32O2Si and a molecular weight of 284.52 g/mol. Its IUPAC name is ethyl (2E)-2-(trimethylsilylmethylidene)decanoate.

Molecular Properties

Compound Nameethyl (2E)-2-(trimethylsilylmethylidene)decanoate
PubChem CID10968059
Molecular FormulaC16H32O2Si
Molecular Weight284.52 g/mol
Exact Mass284.22
IUPAC Nameethyl (2E)-2-(trimethylsilylmethylidene)decanoate
SMILESCCCCCCCC/C(=C\[Si](C)(C)C)C(=O)OCC
InChIInChI=1S/C16H32O2Si/c1-6-8-9-10-11-12-13-15(14-19(3,4)5)16(17)18-7-2/h14H,6-13H2,1-5H3/b15-14+
InChIKeyONUZDQSWRGTQHZ-CCEZHUSRSA-N
XLogP5.10
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.52
LogP ≤ 55.10
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': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze ethyl (2E)-2-(trimethylsilylmethylidene)decanoate with MolForge

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

Launch Full Analysis

Related Compounds

Ethyl 2-methylenetridecanoate
CID 13661680
ethyl (2E)-2-(fluoromethylidene)decanoate
CID 177852420
Ethyl 2-methylidenenonanoate
CID 10703126
Heptanoic acid, 2-methylene-, ethyl ester
CID 12456489
Ethyl 2-methylideneoctanoate
CID 12456491
Ethyl 2-methylidenedecanoate
CID 13191418
3-Methylidene-oxacycloundecan-2-one
CID 14815026
Methyl trans-2,3-methylenedocosanoate
CID 129727335
10-Fluorodecyl 2-methylideneicosanoate
CID 54190719
Dodecyl 9-fluoro-2-methylidenenonanoate
CID 89916737
Ethyl 8-fluoro-2-methylideneoctanoate
CID 118365464
1-Fluoropentyl 2-methylidenedecanoate
CID 139911742

Frequently Asked Questions

What is the IUPAC name of ethyl (2E)-2-(trimethylsilylmethylidene)decanoate?
The IUPAC name of ethyl (2E)-2-(trimethylsilylmethylidene)decanoate (CID 10968059) is ethyl (2E)-2-(trimethylsilylmethylidene)decanoate.
What is the SMILES notation for ethyl (2E)-2-(trimethylsilylmethylidene)decanoate?
The canonical SMILES for ethyl (2E)-2-(trimethylsilylmethylidene)decanoate is CCCCCCCC/C(=C\[Si](C)(C)C)C(=O)OCC.
What is the InChIKey of ethyl (2E)-2-(trimethylsilylmethylidene)decanoate?
The InChIKey is ONUZDQSWRGTQHZ-CCEZHUSRSA-N. The full InChI is InChI=1S/C16H32O2Si/c1-6-8-9-10-11-12-13-15(14-19(3,4)5)16(17)18-7-2/h14H,6-13H2,1-5H3/b15-14+.
What are the key properties of ethyl (2E)-2-(trimethylsilylmethylidene)decanoate?
ethyl (2E)-2-(trimethylsilylmethylidene)decanoate has a molecular weight of 284.52 g/mol, XLogP of 5.10, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl (2E)-2-(trimethylsilylmethylidene)decanoate is sourced from PubChem (CID 10968059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).