dichloro-methyl-propoxysilane

C4H10Cl2OSi — CID 87990062

IUPACdichloro-methyl-propoxysilane
SMILESCCCO[Si](C)(Cl)Cl
InChIInChI=1S/C4H10Cl2OSi/c1-3-4-7-8(2,5)6/h3-4H2,1-2H3
InChIKeyOHLCOLSNBBMKPY-UHFFFAOYSA-N
MW173.11 g/mol
LogP2.46
Rot. Bonds3

About dichloro-methyl-propoxysilane

dichloro-methyl-propoxysilane (PubChem CID 87990062) has the molecular formula C4H10Cl2OSi and a molecular weight of 173.11 g/mol. Its IUPAC name is dichloro-methyl-propoxysilane.

Molecular Properties

Compound Namedichloro-methyl-propoxysilane
PubChem CID87990062
Molecular FormulaC4H10Cl2OSi
Molecular Weight173.11 g/mol
Exact Mass171.99
IUPAC Namedichloro-methyl-propoxysilane
SMILESCCCO[Si](C)(Cl)Cl
InChIInChI=1S/C4H10Cl2OSi/c1-3-4-7-8(2,5)6/h3-4H2,1-2H3
InChIKeyOHLCOLSNBBMKPY-UHFFFAOYSA-N
XLogP2.46
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.11
LogP ≤ 52.46
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'}

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Frequently Asked Questions

What is the IUPAC name of dichloro-methyl-propoxysilane?
The IUPAC name of dichloro-methyl-propoxysilane (CID 87990062) is dichloro-methyl-propoxysilane.
What is the SMILES notation for dichloro-methyl-propoxysilane?
The canonical SMILES for dichloro-methyl-propoxysilane is CCCO[Si](C)(Cl)Cl.
What is the InChIKey of dichloro-methyl-propoxysilane?
The InChIKey is OHLCOLSNBBMKPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10Cl2OSi/c1-3-4-7-8(2,5)6/h3-4H2,1-2H3.
What are the key properties of dichloro-methyl-propoxysilane?
dichloro-methyl-propoxysilane has a molecular weight of 173.11 g/mol, XLogP of 2.46, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-methyl-propoxysilane is sourced from PubChem (CID 87990062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).