(2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane

C13H28OSi — CID 11009726

IUPAC(2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane
SMILESCC1OC1(C)[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C13H28OSi/c1-9(2)15(10(3)4,11(5)6)13(8)12(7)14-13/h9-12H,1-8H3
InChIKeyPHBLLEPDWDPSQH-UHFFFAOYSA-N
MW228.45 g/mol
LogP4.38
Rot. Bonds4

About (2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane

(2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane (PubChem CID 11009726) has the molecular formula C13H28OSi and a molecular weight of 228.45 g/mol. Its IUPAC name is (2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane.

Molecular Properties

Compound Name(2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane
PubChem CID11009726
Molecular FormulaC13H28OSi
Molecular Weight228.45 g/mol
Exact Mass228.19
IUPAC Name(2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane
SMILESCC1OC1(C)[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C13H28OSi/c1-9(2)15(10(3)4,11(5)6)13(8)12(7)14-13/h9-12H,1-8H3
InChIKeyPHBLLEPDWDPSQH-UHFFFAOYSA-N
XLogP4.38
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.45
LogP ≤ 54.38
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 (2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane?
The IUPAC name of (2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane (CID 11009726) is (2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane.
What is the SMILES notation for (2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane?
The canonical SMILES for (2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane is CC1OC1(C)[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of (2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane?
The InChIKey is PHBLLEPDWDPSQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28OSi/c1-9(2)15(10(3)4,11(5)6)13(8)12(7)14-13/h9-12H,1-8H3.
What are the key properties of (2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane?
(2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane has a molecular weight of 228.45 g/mol, XLogP of 4.38, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dimethyloxiran-2-yl)-tri(propan-2-yl)silane is sourced from PubChem (CID 11009726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).