trichloro(1-methoxypropyl)silane

C4H9Cl3OSi — CID 87829916

IUPACtrichloro(1-methoxypropyl)silane
SMILESCCC(OC)[Si](Cl)(Cl)Cl
InChIInChI=1S/C4H9Cl3OSi/c1-3-4(8-2)9(5,6)7/h4H,3H2,1-2H3
InChIKeyNVEJDVHQNTXNPZ-UHFFFAOYSA-N
MW207.56 g/mol
LogP2.61
Rot. Bonds3

About trichloro(1-methoxypropyl)silane

trichloro(1-methoxypropyl)silane (PubChem CID 87829916) has the molecular formula C4H9Cl3OSi and a molecular weight of 207.56 g/mol. Its IUPAC name is trichloro(1-methoxypropyl)silane.

Molecular Properties

Compound Nametrichloro(1-methoxypropyl)silane
PubChem CID87829916
Molecular FormulaC4H9Cl3OSi
Molecular Weight207.56 g/mol
Exact Mass205.95
IUPAC Nametrichloro(1-methoxypropyl)silane
SMILESCCC(OC)[Si](Cl)(Cl)Cl
InChIInChI=1S/C4H9Cl3OSi/c1-3-4(8-2)9(5,6)7/h4H,3H2,1-2H3
InChIKeyNVEJDVHQNTXNPZ-UHFFFAOYSA-N
XLogP2.61
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 ≤ 52.61
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 trichloro(1-methoxypropyl)silane?
The IUPAC name of trichloro(1-methoxypropyl)silane (CID 87829916) is trichloro(1-methoxypropyl)silane.
What is the SMILES notation for trichloro(1-methoxypropyl)silane?
The canonical SMILES for trichloro(1-methoxypropyl)silane is CCC(OC)[Si](Cl)(Cl)Cl.
What is the InChIKey of trichloro(1-methoxypropyl)silane?
The InChIKey is NVEJDVHQNTXNPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9Cl3OSi/c1-3-4(8-2)9(5,6)7/h4H,3H2,1-2H3.
What are the key properties of trichloro(1-methoxypropyl)silane?
trichloro(1-methoxypropyl)silane has a molecular weight of 207.56 g/mol, XLogP of 2.61, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro(1-methoxypropyl)silane is sourced from PubChem (CID 87829916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).