2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane

C12H30OSi3 — CID 66684518

IUPAC2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane
SMILESCCC[Si]1(C)OC(C)(C)C[Si](C)(C)[Si]1(C)C
InChIInChI=1S/C12H30OSi3/c1-9-10-16(8)13-12(2,3)11-14(4,5)15(16,6)7/h9-11H2,1-8H3
InChIKeyWZIKOIGVNOXVKY-UHFFFAOYSA-N
MW274.63 g/mol
LogP4.35
Rot. Bonds2

About 2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane

2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane (PubChem CID 66684518) has the molecular formula C12H30OSi3 and a molecular weight of 274.63 g/mol. Its IUPAC name is 2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane.

Molecular Properties

Compound Name2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane
PubChem CID66684518
Molecular FormulaC12H30OSi3
Molecular Weight274.63 g/mol
Exact Mass274.16
IUPAC Name2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane
SMILESCCC[Si]1(C)OC(C)(C)C[Si](C)(C)[Si]1(C)C
InChIInChI=1S/C12H30OSi3/c1-9-10-16(8)13-12(2,3)11-14(4,5)15(16,6)7/h9-11H2,1-8H3
InChIKeyWZIKOIGVNOXVKY-UHFFFAOYSA-N
XLogP4.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.63
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane?
The IUPAC name of 2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane (CID 66684518) is 2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane.
What is the SMILES notation for 2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane?
The canonical SMILES for 2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane is CCC[Si]1(C)OC(C)(C)C[Si](C)(C)[Si]1(C)C.
What is the InChIKey of 2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane?
The InChIKey is WZIKOIGVNOXVKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H30OSi3/c1-9-10-16(8)13-12(2,3)11-14(4,5)15(16,6)7/h9-11H2,1-8H3.
What are the key properties of 2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane?
2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane has a molecular weight of 274.63 g/mol, XLogP of 4.35, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3,4,4,6,6-heptamethyl-2-propyloxatrisilinane is sourced from PubChem (CID 66684518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).