propoxy(trichloromethyl)silane

C4H9Cl3OSi — CID 154081692

IUPACpropoxy(trichloromethyl)silane
SMILESCCCO[SiH2]C(Cl)(Cl)Cl
InChIInChI=1S/C4H9Cl3OSi/c1-2-3-8-9-4(5,6)7/h2-3,9H2,1H3
InChIKeyOIALSCQOSLYOKV-UHFFFAOYSA-N
MW207.56 g/mol
LogP1.82
Rot. Bonds3

About propoxy(trichloromethyl)silane

propoxy(trichloromethyl)silane (PubChem CID 154081692) has the molecular formula C4H9Cl3OSi and a molecular weight of 207.56 g/mol. Its IUPAC name is propoxy(trichloromethyl)silane.

Molecular Properties

Compound Namepropoxy(trichloromethyl)silane
PubChem CID154081692
Molecular FormulaC4H9Cl3OSi
Molecular Weight207.56 g/mol
Exact Mass205.95
IUPAC Namepropoxy(trichloromethyl)silane
SMILESCCCO[SiH2]C(Cl)(Cl)Cl
InChIInChI=1S/C4H9Cl3OSi/c1-2-3-8-9-4(5,6)7/h2-3,9H2,1H3
InChIKeyOIALSCQOSLYOKV-UHFFFAOYSA-N
XLogP1.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.56
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

butane;methyl(propoxy)silane
CID 123175569
2-propoxysilylethane-1,1,1-triamine
CID 175412053
1,1-dichloro-1-propoxypropane
CID 87434594
2,2-dichloro-1-propoxypropane
CID 91753628
butane;tetrachloromethane
CID 175704167
butane;chloromethane
CID 23360987
tert-butyl(3-pentoxypropoxy)silane
CID 123911928
1,2-dipropoxyhydrazine
CID 151105951
1-(1,2,2-tripropoxyethenoxy)propane
CID 12561622
lithium;butoxy(2,3-dimethylbutan-2-yl)silane;hydride
CID 174817482
butoxy(propoxy)silane;ethanol;molybdenum
CID 159427488
dichloro(propoxy)phosphane
CID 536189

Frequently Asked Questions

What is the IUPAC name of propoxy(trichloromethyl)silane?
The IUPAC name of propoxy(trichloromethyl)silane (CID 154081692) is propoxy(trichloromethyl)silane.
What is the SMILES notation for propoxy(trichloromethyl)silane?
The canonical SMILES for propoxy(trichloromethyl)silane is CCCO[SiH2]C(Cl)(Cl)Cl.
What is the InChIKey of propoxy(trichloromethyl)silane?
The InChIKey is OIALSCQOSLYOKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9Cl3OSi/c1-2-3-8-9-4(5,6)7/h2-3,9H2,1H3.
What are the key properties of propoxy(trichloromethyl)silane?
propoxy(trichloromethyl)silane has a molecular weight of 207.56 g/mol, XLogP of 1.82, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for propoxy(trichloromethyl)silane is sourced from PubChem (CID 154081692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).