trimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane

C12H24OSi — CID 86668734

IUPACtrimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane
SMILESC=C(/C=C/CCCCC)O[Si](C)(C)C
InChIInChI=1S/C12H24OSi/c1-6-7-8-9-10-11-12(2)13-14(3,4)5/h10-11H,2,6-9H2,1,3-5H3/b11-10+
InChIKeyRAXUQPBXXCVQQJ-ZHACJKMWSA-N
MW212.41 g/mol
LogP4.49
Rot. Bonds7

About trimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane

trimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane (PubChem CID 86668734) has the molecular formula C12H24OSi and a molecular weight of 212.41 g/mol. Its IUPAC name is trimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane
PubChem CID86668734
Molecular FormulaC12H24OSi
Molecular Weight212.41 g/mol
Exact Mass212.16
IUPAC Nametrimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane
SMILESC=C(/C=C/CCCCC)O[Si](C)(C)C
InChIInChI=1S/C12H24OSi/c1-6-7-8-9-10-11-12(2)13-14(3,4)5/h10-11H,2,6-9H2,1,3-5H3/b11-10+
InChIKeyRAXUQPBXXCVQQJ-ZHACJKMWSA-N
XLogP4.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.41
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane?
The IUPAC name of trimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane (CID 86668734) is trimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane.
What is the SMILES notation for trimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane?
The canonical SMILES for trimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane is C=C(/C=C/CCCCC)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane?
The InChIKey is RAXUQPBXXCVQQJ-ZHACJKMWSA-N. The full InChI is InChI=1S/C12H24OSi/c1-6-7-8-9-10-11-12(2)13-14(3,4)5/h10-11H,2,6-9H2,1,3-5H3/b11-10+.
What are the key properties of trimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane?
trimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane has a molecular weight of 212.41 g/mol, XLogP of 4.49, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(3E)-nona-1,3-dien-2-yl]oxysilane is sourced from PubChem (CID 86668734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).