trimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane

C14H28O5Si — CID 150069875

IUPACtrimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane
SMILESC=C(CCCOCC1CO1)CCC[Si](OC)(OC)OC
InChIInChI=1S/C14H28O5Si/c1-13(7-5-9-18-11-14-12-19-14)8-6-10-20(15-2,16-3)17-4/h14H,1,5-12H2,2-4H3
InChIKeyDPAXEFVBNVHJFN-UHFFFAOYSA-N
MW304.46 g/mol
LogP2.40
Rot. Bonds13

About trimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane

trimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane (PubChem CID 150069875) has the molecular formula C14H28O5Si and a molecular weight of 304.46 g/mol. Its IUPAC name is trimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane.

Molecular Properties

Compound Nametrimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane
PubChem CID150069875
Molecular FormulaC14H28O5Si
Molecular Weight304.46 g/mol
Exact Mass304.17
IUPAC Nametrimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane
SMILESC=C(CCCOCC1CO1)CCC[Si](OC)(OC)OC
InChIInChI=1S/C14H28O5Si/c1-13(7-5-9-18-11-14-12-19-14)8-6-10-20(15-2,16-3)17-4/h14H,1,5-12H2,2-4H3
InChIKeyDPAXEFVBNVHJFN-UHFFFAOYSA-N
XLogP2.40
TPSA49.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.46
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane?
The IUPAC name of trimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane (CID 150069875) is trimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane.
What is the SMILES notation for trimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane?
The canonical SMILES for trimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane is C=C(CCCOCC1CO1)CCC[Si](OC)(OC)OC.
What is the InChIKey of trimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane?
The InChIKey is DPAXEFVBNVHJFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O5Si/c1-13(7-5-9-18-11-14-12-19-14)8-6-10-20(15-2,16-3)17-4/h14H,1,5-12H2,2-4H3.
What are the key properties of trimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane?
trimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane has a molecular weight of 304.46 g/mol, XLogP of 2.40, 13 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy-[4-methylidene-7-(oxiran-2-ylmethoxy)heptyl]silane is sourced from PubChem (CID 150069875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).