tributyl-[(E)-undec-2-enoxy]silane

C23H48OSi — CID 5353201

IUPACtributyl-[(E)-undec-2-enoxy]silane
SMILESCCCCCCCC/C=C/CO[Si](CCCC)(CCCC)CCCC
InChIInChI=1S/C23H48OSi/c1-5-9-13-14-15-16-17-18-19-20-24-25(21-10-6-2,22-11-7-3)23-12-8-4/h18-19H,5-17,20-23H2,1-4H3/b19-18+
InChIKeyKSXQKDXDRHBTOA-VHEBQXMUSA-N
MW368.72 g/mol
LogP8.66
Rot. Bonds19

About tributyl-[(E)-undec-2-enoxy]silane

tributyl-[(E)-undec-2-enoxy]silane (PubChem CID 5353201) has the molecular formula C23H48OSi and a molecular weight of 368.72 g/mol. Its IUPAC name is tributyl-[(E)-undec-2-enoxy]silane.

Molecular Properties

Compound Nametributyl-[(E)-undec-2-enoxy]silane
PubChem CID5353201
Molecular FormulaC23H48OSi
Molecular Weight368.72 g/mol
Exact Mass368.35
IUPAC Nametributyl-[(E)-undec-2-enoxy]silane
SMILESCCCCCCCC/C=C/CO[Si](CCCC)(CCCC)CCCC
InChIInChI=1S/C23H48OSi/c1-5-9-13-14-15-16-17-18-19-20-24-25(21-10-6-2,22-11-7-3)23-12-8-4/h18-19H,5-17,20-23H2,1-4H3/b19-18+
InChIKeyKSXQKDXDRHBTOA-VHEBQXMUSA-N
XLogP8.66
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds19
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.72
LogP ≤ 58.66
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'}

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Related Compounds

Geraniol, tert-butyldimethylsilyl ether
CID 6536899
2-Decen-1-ol, (E)-, TMS derivative
CID 14970964
Farnesol, tert-butyldimethylsilyl ether
CID 10337114
1-Triisobutylsilyloxyundec-2-ene
CID 5353181
1-Trimethylsilyoxylundec-2-ene
CID 5353184
1-Dimethylisopropylsilyloxyundec-2-ene
CID 5353188
2-Dimethyloctylsilyloxyoct-3-ene
CID 5353190
1-Dimethyloctylsilyloxyundec-2-ene
CID 5353191
2-Tripropylsilyloxyoct-3-ene
CID 5353192
1-Tripropylsilyloxyundec-2-ene
CID 5353193
2-Trihexylsilyloxyoct-3-ene
CID 5353195
1-Trihexylsilyloxyundec-2-ene
CID 5353196

Frequently Asked Questions

What is the IUPAC name of tributyl-[(E)-undec-2-enoxy]silane?
The IUPAC name of tributyl-[(E)-undec-2-enoxy]silane (CID 5353201) is tributyl-[(E)-undec-2-enoxy]silane.
What is the SMILES notation for tributyl-[(E)-undec-2-enoxy]silane?
The canonical SMILES for tributyl-[(E)-undec-2-enoxy]silane is CCCCCCCC/C=C/CO[Si](CCCC)(CCCC)CCCC.
What is the InChIKey of tributyl-[(E)-undec-2-enoxy]silane?
The InChIKey is KSXQKDXDRHBTOA-VHEBQXMUSA-N. The full InChI is InChI=1S/C23H48OSi/c1-5-9-13-14-15-16-17-18-19-20-24-25(21-10-6-2,22-11-7-3)23-12-8-4/h18-19H,5-17,20-23H2,1-4H3/b19-18+.
What are the key properties of tributyl-[(E)-undec-2-enoxy]silane?
tributyl-[(E)-undec-2-enoxy]silane has a molecular weight of 368.72 g/mol, XLogP of 8.66, 19 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-[(E)-undec-2-enoxy]silane is sourced from PubChem (CID 5353201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).