1,1-dichloropropan-2-yloxysilane

C3H8Cl2OSi — CID 173050518

IUPAC1,1-dichloropropan-2-yloxysilane
SMILESCC(O[SiH3])C(Cl)Cl
InChIInChI=1S/C3H8Cl2OSi/c1-2(6-7)3(4)5/h2-3H,1,7H3
InChIKeyZPGUZVGKNNMLJY-UHFFFAOYSA-N
MW159.09 g/mol
LogP0.48
Rot. Bonds2

About 1,1-dichloropropan-2-yloxysilane

1,1-dichloropropan-2-yloxysilane (PubChem CID 173050518) has the molecular formula C3H8Cl2OSi and a molecular weight of 159.09 g/mol. Its IUPAC name is 1,1-dichloropropan-2-yloxysilane.

Molecular Properties

Compound Name1,1-dichloropropan-2-yloxysilane
PubChem CID173050518
Molecular FormulaC3H8Cl2OSi
Molecular Weight159.09 g/mol
Exact Mass157.97
IUPAC Name1,1-dichloropropan-2-yloxysilane
SMILESCC(O[SiH3])C(Cl)Cl
InChIInChI=1S/C3H8Cl2OSi/c1-2(6-7)3(4)5/h2-3H,1,7H3
InChIKeyZPGUZVGKNNMLJY-UHFFFAOYSA-N
XLogP0.48
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.09
LogP ≤ 50.48
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'}

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Frequently Asked Questions

What is the IUPAC name of 1,1-dichloropropan-2-yloxysilane?
The IUPAC name of 1,1-dichloropropan-2-yloxysilane (CID 173050518) is 1,1-dichloropropan-2-yloxysilane.
What is the SMILES notation for 1,1-dichloropropan-2-yloxysilane?
The canonical SMILES for 1,1-dichloropropan-2-yloxysilane is CC(O[SiH3])C(Cl)Cl.
What is the InChIKey of 1,1-dichloropropan-2-yloxysilane?
The InChIKey is ZPGUZVGKNNMLJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8Cl2OSi/c1-2(6-7)3(4)5/h2-3H,1,7H3.
What are the key properties of 1,1-dichloropropan-2-yloxysilane?
1,1-dichloropropan-2-yloxysilane has a molecular weight of 159.09 g/mol, XLogP of 0.48, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dichloropropan-2-yloxysilane is sourced from PubChem (CID 173050518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).