2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane

C11H22OSi — CID 18455989

IUPAC2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane
SMILESC#CCO[Si](C)(C)C(C)(C)C(C)C
InChIInChI=1S/C11H22OSi/c1-8-9-12-13(6,7)11(4,5)10(2)3/h1,10H,9H2,2-7H3
InChIKeyYKDFOISMKDDOOR-UHFFFAOYSA-N
MW198.38 g/mol
LogP3.28
Rot. Bonds4

About 2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane

2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane (PubChem CID 18455989) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is 2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane.

Molecular Properties

Compound Name2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane
PubChem CID18455989
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Name2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane
SMILESC#CCO[Si](C)(C)C(C)(C)C(C)C
InChIInChI=1S/C11H22OSi/c1-8-9-12-13(6,7)11(4,5)10(2)3/h1,10H,9H2,2-7H3
InChIKeyYKDFOISMKDDOOR-UHFFFAOYSA-N
XLogP3.28
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.38
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane?
The IUPAC name of 2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane (CID 18455989) is 2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane.
What is the SMILES notation for 2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane?
The canonical SMILES for 2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane is C#CCO[Si](C)(C)C(C)(C)C(C)C.
What is the InChIKey of 2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane?
The InChIKey is YKDFOISMKDDOOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22OSi/c1-8-9-12-13(6,7)11(4,5)10(2)3/h1,10H,9H2,2-7H3.
What are the key properties of 2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane?
2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane has a molecular weight of 198.38 g/mol, XLogP of 3.28, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylbutan-2-yl-dimethyl-prop-2-ynoxysilane is sourced from PubChem (CID 18455989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).