silylsilane;1,1,2-trimethoxynona-1,4-diene

C12H28O3Si2 — CID 161049583

IUPACsilylsilane;1,1,2-trimethoxynona-1,4-diene
SMILESCCCCC=CCC(OC)=C(OC)OC.[SiH3][SiH3]
InChIInChI=1S/C12H22O3.H6Si2/c1-5-6-7-8-9-10-11(13-2)12(14-3)15-4;1-2/h8-9H,5-7,10H2,1-4H3;1-2H3
InChIKeyUBYLEQJAQHEQSR-UHFFFAOYSA-N
MW276.52 g/mol
LogP0.86
Rot. Bonds8

About silylsilane;1,1,2-trimethoxynona-1,4-diene

silylsilane;1,1,2-trimethoxynona-1,4-diene (PubChem CID 161049583) has the molecular formula C12H28O3Si2 and a molecular weight of 276.52 g/mol. Its IUPAC name is silylsilane;1,1,2-trimethoxynona-1,4-diene.

Molecular Properties

Compound Namesilylsilane;1,1,2-trimethoxynona-1,4-diene
PubChem CID161049583
Molecular FormulaC12H28O3Si2
Molecular Weight276.52 g/mol
Exact Mass276.16
IUPAC Namesilylsilane;1,1,2-trimethoxynona-1,4-diene
SMILESCCCCC=CCC(OC)=C(OC)OC.[SiH3][SiH3]
InChIInChI=1S/C12H22O3.H6Si2/c1-5-6-7-8-9-10-11(13-2)12(14-3)15-4;1-2/h8-9H,5-7,10H2,1-4H3;1-2H3
InChIKeyUBYLEQJAQHEQSR-UHFFFAOYSA-N
XLogP0.86
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.52
LogP ≤ 50.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

methyl dec-5-enoate
CID 54534253
methyl (Z)-hexadec-3-enoate
CID 91746830
methyl tridec-3-enoate
CID 72597559
methyl (E)-hexadec-11-enoate
CID 5364696
dec-5-ene;trihydrobromide
CID 175802238
2-methylundeca-1,6-diene
CID 173154459
(Z)-1-methoxynon-4-ene
CID 59123720
methyl (Z)-undec-5-enoate
CID 11469683
methyl (3E,6E)-octadeca-3,6-dienoate
CID 14122947
(2E,7E)-dodeca-2,7-diene
CID 173295735
hept-2-ene;methanol
CID 135236025
methyl (E)-octadec-12-enoate
CID 5364503

Frequently Asked Questions

What is the IUPAC name of silylsilane;1,1,2-trimethoxynona-1,4-diene?
The IUPAC name of silylsilane;1,1,2-trimethoxynona-1,4-diene (CID 161049583) is silylsilane;1,1,2-trimethoxynona-1,4-diene.
What is the SMILES notation for silylsilane;1,1,2-trimethoxynona-1,4-diene?
The canonical SMILES for silylsilane;1,1,2-trimethoxynona-1,4-diene is CCCCC=CCC(OC)=C(OC)OC.[SiH3][SiH3].
What is the InChIKey of silylsilane;1,1,2-trimethoxynona-1,4-diene?
The InChIKey is UBYLEQJAQHEQSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O3.H6Si2/c1-5-6-7-8-9-10-11(13-2)12(14-3)15-4;1-2/h8-9H,5-7,10H2,1-4H3;1-2H3.
What are the key properties of silylsilane;1,1,2-trimethoxynona-1,4-diene?
silylsilane;1,1,2-trimethoxynona-1,4-diene has a molecular weight of 276.52 g/mol, XLogP of 0.86, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for silylsilane;1,1,2-trimethoxynona-1,4-diene is sourced from PubChem (CID 161049583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).