[(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane

C19H36O2Si — CID 135079640

IUPAC[(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane
SMILESC=CC(CCC)O[Si](OC(/C=C/C)/C=C/C)(C(C)C)C(C)C
InChIInChI=1S/C19H36O2Si/c1-9-13-18(12-4)20-22(16(5)6,17(7)8)21-19(14-10-2)15-11-3/h10-12,14-19H,4,9,13H2,1-3,5-8H3/b14-10+,15-11+
InChIKeyZNHHRUULKOBRPL-WFYKWJGLSA-N
MW324.58 g/mol
LogP6.16
Rot. Bonds11

About [(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane

[(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane (PubChem CID 135079640) has the molecular formula C19H36O2Si and a molecular weight of 324.58 g/mol. Its IUPAC name is [(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane.

Molecular Properties

Compound Name[(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane
PubChem CID135079640
Molecular FormulaC19H36O2Si
Molecular Weight324.58 g/mol
Exact Mass324.25
IUPAC Name[(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane
SMILESC=CC(CCC)O[Si](OC(/C=C/C)/C=C/C)(C(C)C)C(C)C
InChIInChI=1S/C19H36O2Si/c1-9-13-18(12-4)20-22(16(5)6,17(7)8)21-19(14-10-2)15-11-3/h10-12,14-19H,4,9,13H2,1-3,5-8H3/b14-10+,15-11+
InChIKeyZNHHRUULKOBRPL-WFYKWJGLSA-N
XLogP6.16
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.58
LogP ≤ 56.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

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CID 10977584
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1,8-cis-Undecadien-5-yne 3,7-bis-trimethylsilyl ether
CID 91696575
Tert-butyl-cyclopent-2-en-1-yloxy-dimethylsilane
CID 9815574
tert-Butyl(cyclohex-2-enyloxy)dimethylsilane
CID 11085130
[(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane
CID 11543224
tert-butyl-[(1S)-cyclopent-2-en-1-yl]oxy-dimethylsilane
CID 12445093
tert-butyl-[(1S,4R)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]oxy-dimethylsilane
CID 15110385
tert-butyl-[(2E,6E)-5-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,6-dienoxy]-dimethylsilane
CID 5387042
2-Triisobutylsilyloxyoct-3-ene
CID 5353180
2-Trimethylsilyloxyoct-3-ene
CID 5353183
2-Dimethylisopropylsilyloxyoct-3-ene
CID 5353187

Frequently Asked Questions

What is the IUPAC name of [(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane?
The IUPAC name of [(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane (CID 135079640) is [(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane.
What is the SMILES notation for [(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane?
The canonical SMILES for [(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane is C=CC(CCC)O[Si](OC(/C=C/C)/C=C/C)(C(C)C)C(C)C.
What is the InChIKey of [(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane?
The InChIKey is ZNHHRUULKOBRPL-WFYKWJGLSA-N. The full InChI is InChI=1S/C19H36O2Si/c1-9-13-18(12-4)20-22(16(5)6,17(7)8)21-19(14-10-2)15-11-3/h10-12,14-19H,4,9,13H2,1-3,5-8H3/b14-10+,15-11+.
What are the key properties of [(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane?
[(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane has a molecular weight of 324.58 g/mol, XLogP of 6.16, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2E,5E)-hepta-2,5-dien-4-yl]oxy-hex-1-en-3-yloxy-di(propan-2-yl)silane is sourced from PubChem (CID 135079640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).