[1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane

C18H40OSi2 — CID 90961645

IUPAC[1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane
SMILESCCC(O[Si](C)(C)C(C)(CC)CC)(C1CC1)[Si](C)(C)CC
InChIInChI=1S/C18H40OSi2/c1-10-17(5,11-2)21(8,9)19-18(12-3,16-14-15-16)20(6,7)13-4/h16H,10-15H2,1-9H3
InChIKeyLKKAHXVUAPCBJU-UHFFFAOYSA-N
MW328.69 g/mol
LogP6.61
Rot. Bonds9

About [1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane

[1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane (PubChem CID 90961645) has the molecular formula C18H40OSi2 and a molecular weight of 328.69 g/mol. Its IUPAC name is [1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane.

Molecular Properties

Compound Name[1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane
PubChem CID90961645
Molecular FormulaC18H40OSi2
Molecular Weight328.69 g/mol
Exact Mass328.26
IUPAC Name[1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane
SMILESCCC(O[Si](C)(C)C(C)(CC)CC)(C1CC1)[Si](C)(C)CC
InChIInChI=1S/C18H40OSi2/c1-10-17(5,11-2)21(8,9)19-18(12-3,16-14-15-16)20(6,7)13-4/h16H,10-15H2,1-9H3
InChIKeyLKKAHXVUAPCBJU-UHFFFAOYSA-N
XLogP6.61
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.69
LogP ≤ 56.61
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 [1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane?
The IUPAC name of [1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane (CID 90961645) is [1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane.
What is the SMILES notation for [1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane?
The canonical SMILES for [1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane is CCC(O[Si](C)(C)C(C)(CC)CC)(C1CC1)[Si](C)(C)CC.
What is the InChIKey of [1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane?
The InChIKey is LKKAHXVUAPCBJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H40OSi2/c1-10-17(5,11-2)21(8,9)19-18(12-3,16-14-15-16)20(6,7)13-4/h16H,10-15H2,1-9H3.
What are the key properties of [1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane?
[1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane has a molecular weight of 328.69 g/mol, XLogP of 6.61, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-cyclopropyl-1-[dimethyl(3-methylpentan-3-yl)silyl]oxypropyl]-ethyl-dimethylsilane is sourced from PubChem (CID 90961645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).