tert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane

C9H21ClOSi2 — CID 174051735

IUPACtert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane
SMILESC=C(CO[Si](C)(C)C(C)(C)C)[SiH2]Cl
InChIInChI=1S/C9H21ClOSi2/c1-8(12-10)7-11-13(5,6)9(2,3)4/h1,7,12H2,2-6H3
InChIKeyAJRDJEAWYCXOOB-UHFFFAOYSA-N
MW236.89 g/mol
LogP2.84
Rot. Bonds4

About tert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane

tert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane (PubChem CID 174051735) has the molecular formula C9H21ClOSi2 and a molecular weight of 236.89 g/mol. Its IUPAC name is tert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane
PubChem CID174051735
Molecular FormulaC9H21ClOSi2
Molecular Weight236.89 g/mol
Exact Mass236.08
IUPAC Nametert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane
SMILESC=C(CO[Si](C)(C)C(C)(C)C)[SiH2]Cl
InChIInChI=1S/C9H21ClOSi2/c1-8(12-10)7-11-13(5,6)9(2,3)4/h1,7,12H2,2-6H3
InChIKeyAJRDJEAWYCXOOB-UHFFFAOYSA-N
XLogP2.84
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.89
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze tert-butyl-(2-chlorosilylprop-2-enoxy)-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 tert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane?
The IUPAC name of tert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane (CID 174051735) is tert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane.
What is the SMILES notation for tert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane?
The canonical SMILES for tert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane is C=C(CO[Si](C)(C)C(C)(C)C)[SiH2]Cl.
What is the InChIKey of tert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane?
The InChIKey is AJRDJEAWYCXOOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21ClOSi2/c1-8(12-10)7-11-13(5,6)9(2,3)4/h1,7,12H2,2-6H3.
What are the key properties of tert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane?
tert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane has a molecular weight of 236.89 g/mol, XLogP of 2.84, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(2-chlorosilylprop-2-enoxy)-dimethylsilane is sourced from PubChem (CID 174051735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).