triethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane

C19H36OSi — CID 46895233

IUPACtriethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane
SMILESC/C=C(\C)C(C#CCCCCCC)O[Si](CC)(CC)CC
InChIInChI=1S/C19H36OSi/c1-7-12-13-14-15-16-17-19(18(6)8-2)20-21(9-3,10-4)11-5/h8,19H,7,9-15H2,1-6H3/b18-8+
InChIKeyOJRIJOIYIWMJAO-QGMBQPNBSA-N
MW308.58 g/mol
LogP6.32
Rot. Bonds10

About triethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane

triethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane (PubChem CID 46895233) has the molecular formula C19H36OSi and a molecular weight of 308.58 g/mol. Its IUPAC name is triethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane.

Molecular Properties

Compound Nametriethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane
PubChem CID46895233
Molecular FormulaC19H36OSi
Molecular Weight308.58 g/mol
Exact Mass308.25
IUPAC Nametriethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane
SMILESC/C=C(\C)C(C#CCCCCCC)O[Si](CC)(CC)CC
InChIInChI=1S/C19H36OSi/c1-7-12-13-14-15-16-17-19(18(6)8-2)20-21(9-3,10-4)11-5/h8,19H,7,9-15H2,1-6H3/b18-8+
InChIKeyOJRIJOIYIWMJAO-QGMBQPNBSA-N
XLogP6.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.58
LogP ≤ 56.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze triethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane 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

tert-Butyl(dimethyl)silyl 1-vinyl-2,4-dodecadiynyl ether
CID 385446
(S,Z)-(Heptadeca-1,9-dien-4,6-diyn-3-yloxy)trimethylsilane
CID 91696433
Tert-butyl-dimethyl-(2-methyloct-2-en-7-yn-4-yloxy)silane
CID 13789160
tert-butyl-[(E,4R,5R)-3,5-dimethyloct-2-en-6-yn-4-yl]oxy-dimethylsilane
CID 16125838
[(Z,3S)-1-bromododec-4-en-1-yn-3-yl]oxy-tert-butyl-dimethylsilane
CID 24777979
Tert-butyl-dimethyl-(5-methylhex-4-en-1-yn-3-yloxy)silane
CID 57332464
6,10-Dimethylundeca-5,9-dien-4-yloxy(triethyl)silane
CID 73038104
tert-butyl-dimethyl-[(Z,2R)-undec-3-en-2-yl]oxysilane
CID 134855917
tert-butyl-[(2E)-3,7-dimethylundeca-2,6-dien-10-ynoxy]-dimethylsilane
CID 134866067
tert-butyl-[(2E)-3,7-dimethyldodeca-2,6-dien-10-ynoxy]-dimethylsilane
CID 134866068
(6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol
CID 134875012
tri(propan-2-yl)-[(5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-1-yn-4-yl]oxysilane
CID 134875143

Frequently Asked Questions

What is the IUPAC name of triethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane?
The IUPAC name of triethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane (CID 46895233) is triethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane.
What is the SMILES notation for triethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane?
The canonical SMILES for triethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane is C/C=C(\C)C(C#CCCCCCC)O[Si](CC)(CC)CC.
What is the InChIKey of triethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane?
The InChIKey is OJRIJOIYIWMJAO-QGMBQPNBSA-N. The full InChI is InChI=1S/C19H36OSi/c1-7-12-13-14-15-16-17-19(18(6)8-2)20-21(9-3,10-4)11-5/h8,19H,7,9-15H2,1-6H3/b18-8+.
What are the key properties of triethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane?
triethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane has a molecular weight of 308.58 g/mol, XLogP of 6.32, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane is sourced from PubChem (CID 46895233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).