dichloromethyl(propan-2-yloxy)silane

C4H10Cl2OSi — CID 71423319

IUPACdichloromethyl(propan-2-yloxy)silane
SMILESCC(C)O[SiH2]C(Cl)Cl
InChIInChI=1S/C4H10Cl2OSi/c1-3(2)7-8-4(5)6/h3-4H,8H2,1-2H3
InChIKeyBIXSMRDZJBFWFD-UHFFFAOYSA-N
MW173.12 g/mol
LogP1.26
Rot. Bonds3

About dichloromethyl(propan-2-yloxy)silane

dichloromethyl(propan-2-yloxy)silane (PubChem CID 71423319) has the molecular formula C4H10Cl2OSi and a molecular weight of 173.12 g/mol. Its IUPAC name is dichloromethyl(propan-2-yloxy)silane.

Molecular Properties

Compound Namedichloromethyl(propan-2-yloxy)silane
PubChem CID71423319
Molecular FormulaC4H10Cl2OSi
Molecular Weight173.12 g/mol
Exact Mass171.99
IUPAC Namedichloromethyl(propan-2-yloxy)silane
SMILESCC(C)O[SiH2]C(Cl)Cl
InChIInChI=1S/C4H10Cl2OSi/c1-3(2)7-8-4(5)6/h3-4H,8H2,1-2H3
InChIKeyBIXSMRDZJBFWFD-UHFFFAOYSA-N
XLogP1.26
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.12
LogP ≤ 51.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze dichloromethyl(propan-2-yloxy)silane 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 dichloromethyl(propan-2-yloxy)silane?
The IUPAC name of dichloromethyl(propan-2-yloxy)silane (CID 71423319) is dichloromethyl(propan-2-yloxy)silane.
What is the SMILES notation for dichloromethyl(propan-2-yloxy)silane?
The canonical SMILES for dichloromethyl(propan-2-yloxy)silane is CC(C)O[SiH2]C(Cl)Cl.
What is the InChIKey of dichloromethyl(propan-2-yloxy)silane?
The InChIKey is BIXSMRDZJBFWFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10Cl2OSi/c1-3(2)7-8-4(5)6/h3-4H,8H2,1-2H3.
What are the key properties of dichloromethyl(propan-2-yloxy)silane?
dichloromethyl(propan-2-yloxy)silane has a molecular weight of 173.12 g/mol, XLogP of 1.26, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloromethyl(propan-2-yloxy)silane is sourced from PubChem (CID 71423319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).