[(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane

C22H42OSi — CID 135008415

IUPAC[(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane
SMILESC/C=C\C/C=C(/C)C/C(C)=C/CCO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C22H42OSi/c1-10-11-12-14-21(8)17-22(9)15-13-16-23-24(18(2)3,19(4)5)20(6)7/h10-11,14-15,18-20H,12-13,16-17H2,1-9H3/b11-10-,21-14-,22-15+
InChIKeyFAHUNJAZXOPXFJ-ZAPMHWAFSA-N
MW350.66 g/mol
LogP7.82
Rot. Bonds11

About [(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane

[(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane (PubChem CID 135008415) has the molecular formula C22H42OSi and a molecular weight of 350.66 g/mol. Its IUPAC name is [(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane
PubChem CID135008415
Molecular FormulaC22H42OSi
Molecular Weight350.66 g/mol
Exact Mass350.30
IUPAC Name[(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane
SMILESC/C=C\C/C=C(/C)C/C(C)=C/CCO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C22H42OSi/c1-10-11-12-14-21(8)17-22(9)15-13-16-23-24(18(2)3,19(4)5)20(6)7/h10-11,14-15,18-20H,12-13,16-17H2,1-9H3/b11-10-,21-14-,22-15+
InChIKeyFAHUNJAZXOPXFJ-ZAPMHWAFSA-N
XLogP7.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.66
LogP ≤ 57.82
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
4-Hexen-1-ol, (4E)-, tert-butyldimethylsilyl ether
CID 15936622
Farnesol, tert-butyldimethylsilyl ether
CID 10337114
trans-3-Hexen-1-ol, tert-butyldimethylsilyl ether
CID 12010767
Silane, dimethyldi(trans-3,7-dimethyl-2,6-octadien-1-yloxy)-
CID 19045075
cis-3-Hexen-1-ol, tert-butyldimethylsilyl ether
CID 91722567
tert-Butyl(hepta-3,6-dienyloxy)dimethylsilane
CID 14214598
tert-butyl-dimethyl-[(4E,6E,8E)-trideca-4,6,8,12-tetraenoxy]silane
CID 134866952
tert-butyl-[(Z)-hex-4-enoxy]-dimethylsilane
CID 162397527
Tert-butyl(cyclopent-3-en-1-yloxy)dimethylsilane
CID 11106335
tert-butyl-[(E)-hept-5-enoxy]-dimethylsilane
CID 58815025
[(2E)-3,7-dimethylocta-2,6-dienyl]-triethoxysilane
CID 88814215

Frequently Asked Questions

What is the IUPAC name of [(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane?
The IUPAC name of [(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane (CID 135008415) is [(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane.
What is the SMILES notation for [(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane?
The canonical SMILES for [(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane is C/C=C\C/C=C(/C)C/C(C)=C/CCO[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of [(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane?
The InChIKey is FAHUNJAZXOPXFJ-ZAPMHWAFSA-N. The full InChI is InChI=1S/C22H42OSi/c1-10-11-12-14-21(8)17-22(9)15-13-16-23-24(18(2)3,19(4)5)20(6)7/h10-11,14-15,18-20H,12-13,16-17H2,1-9H3/b11-10-,21-14-,22-15+.
What are the key properties of [(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane?
[(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane has a molecular weight of 350.66 g/mol, XLogP of 7.82, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane is sourced from PubChem (CID 135008415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).