buta-2,3-dienoxy-tert-butyl-dimethylsilane

C10H20OSi — CID 10986976

IUPACbuta-2,3-dienoxy-tert-butyl-dimethylsilane
SMILESC=C=CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C10H20OSi/c1-7-8-9-11-12(5,6)10(2,3)4/h8H,1,9H2,2-6H3
InChIKeyGGESMLNOMIPHKW-UHFFFAOYSA-N
MW184.35 g/mol
LogP3.35
Rot. Bonds3

About buta-2,3-dienoxy-tert-butyl-dimethylsilane

buta-2,3-dienoxy-tert-butyl-dimethylsilane (PubChem CID 10986976) has the molecular formula C10H20OSi and a molecular weight of 184.35 g/mol. Its IUPAC name is buta-2,3-dienoxy-tert-butyl-dimethylsilane.

Molecular Properties

Compound Namebuta-2,3-dienoxy-tert-butyl-dimethylsilane
PubChem CID10986976
Molecular FormulaC10H20OSi
Molecular Weight184.35 g/mol
Exact Mass184.13
IUPAC Namebuta-2,3-dienoxy-tert-butyl-dimethylsilane
SMILESC=C=CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C10H20OSi/c1-7-8-9-11-12(5,6)10(2,3)4/h8H,1,9H2,2-6H3
InChIKeyGGESMLNOMIPHKW-UHFFFAOYSA-N
XLogP3.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.35
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze buta-2,3-dienoxy-tert-butyl-dimethylsilane 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 buta-2,3-dienoxy-tert-butyl-dimethylsilane?
The IUPAC name of buta-2,3-dienoxy-tert-butyl-dimethylsilane (CID 10986976) is buta-2,3-dienoxy-tert-butyl-dimethylsilane.
What is the SMILES notation for buta-2,3-dienoxy-tert-butyl-dimethylsilane?
The canonical SMILES for buta-2,3-dienoxy-tert-butyl-dimethylsilane is C=C=CCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of buta-2,3-dienoxy-tert-butyl-dimethylsilane?
The InChIKey is GGESMLNOMIPHKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20OSi/c1-7-8-9-11-12(5,6)10(2,3)4/h8H,1,9H2,2-6H3.
What are the key properties of buta-2,3-dienoxy-tert-butyl-dimethylsilane?
buta-2,3-dienoxy-tert-butyl-dimethylsilane has a molecular weight of 184.35 g/mol, XLogP of 3.35, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for buta-2,3-dienoxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 10986976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).