(3-butyloxiran-2-yl)-trimethylsilane

C9H20OSi — CID 13244705

IUPAC(3-butyloxiran-2-yl)-trimethylsilane
SMILESCCCCC1OC1[Si](C)(C)C
InChIInChI=1S/C9H20OSi/c1-5-6-7-8-9(10-8)11(2,3)4/h8-9H,5-7H2,1-4H3
InChIKeyLTKFPWABKOKNMF-UHFFFAOYSA-N
MW172.34 g/mol
LogP2.82
Rot. Bonds4

About (3-butyloxiran-2-yl)-trimethylsilane

(3-butyloxiran-2-yl)-trimethylsilane (PubChem CID 13244705) has the molecular formula C9H20OSi and a molecular weight of 172.34 g/mol. Its IUPAC name is (3-butyloxiran-2-yl)-trimethylsilane.

Molecular Properties

Compound Name(3-butyloxiran-2-yl)-trimethylsilane
PubChem CID13244705
Molecular FormulaC9H20OSi
Molecular Weight172.34 g/mol
Exact Mass172.13
IUPAC Name(3-butyloxiran-2-yl)-trimethylsilane
SMILESCCCCC1OC1[Si](C)(C)C
InChIInChI=1S/C9H20OSi/c1-5-6-7-8-9(10-8)11(2,3)4/h8-9H,5-7H2,1-4H3
InChIKeyLTKFPWABKOKNMF-UHFFFAOYSA-N
XLogP2.82
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.34
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3-butyloxiran-2-yl)-trimethylsilane?
The IUPAC name of (3-butyloxiran-2-yl)-trimethylsilane (CID 13244705) is (3-butyloxiran-2-yl)-trimethylsilane.
What is the SMILES notation for (3-butyloxiran-2-yl)-trimethylsilane?
The canonical SMILES for (3-butyloxiran-2-yl)-trimethylsilane is CCCCC1OC1[Si](C)(C)C.
What is the InChIKey of (3-butyloxiran-2-yl)-trimethylsilane?
The InChIKey is LTKFPWABKOKNMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20OSi/c1-5-6-7-8-9(10-8)11(2,3)4/h8-9H,5-7H2,1-4H3.
What are the key properties of (3-butyloxiran-2-yl)-trimethylsilane?
(3-butyloxiran-2-yl)-trimethylsilane has a molecular weight of 172.34 g/mol, XLogP of 2.82, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-butyloxiran-2-yl)-trimethylsilane is sourced from PubChem (CID 13244705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).