(2-chloro-1-methoxyethyl)silane

C3H9ClOSi — CID 173009677

IUPAC(2-chloro-1-methoxyethyl)silane
SMILESCOC([SiH3])CCl
InChIInChI=1S/C3H9ClOSi/c1-5-3(6)2-4/h3H,2H2,1,6H3
InChIKeyNCTGDBROTJOAOX-UHFFFAOYSA-N
MW124.64 g/mol
LogP-0.44
Rot. Bonds2

About (2-chloro-1-methoxyethyl)silane

(2-chloro-1-methoxyethyl)silane (PubChem CID 173009677) has the molecular formula C3H9ClOSi and a molecular weight of 124.64 g/mol. Its IUPAC name is (2-chloro-1-methoxyethyl)silane.

Molecular Properties

Compound Name(2-chloro-1-methoxyethyl)silane
PubChem CID173009677
Molecular FormulaC3H9ClOSi
Molecular Weight124.64 g/mol
Exact Mass124.01
IUPAC Name(2-chloro-1-methoxyethyl)silane
SMILESCOC([SiH3])CCl
InChIInChI=1S/C3H9ClOSi/c1-5-3(6)2-4/h3H,2H2,1,6H3
InChIKeyNCTGDBROTJOAOX-UHFFFAOYSA-N
XLogP-0.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.64
LogP ≤ 5-0.44
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 (2-chloro-1-methoxyethyl)silane?
The IUPAC name of (2-chloro-1-methoxyethyl)silane (CID 173009677) is (2-chloro-1-methoxyethyl)silane.
What is the SMILES notation for (2-chloro-1-methoxyethyl)silane?
The canonical SMILES for (2-chloro-1-methoxyethyl)silane is COC([SiH3])CCl.
What is the InChIKey of (2-chloro-1-methoxyethyl)silane?
The InChIKey is NCTGDBROTJOAOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9ClOSi/c1-5-3(6)2-4/h3H,2H2,1,6H3.
What are the key properties of (2-chloro-1-methoxyethyl)silane?
(2-chloro-1-methoxyethyl)silane has a molecular weight of 124.64 g/mol, XLogP of -0.44, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-1-methoxyethyl)silane is sourced from PubChem (CID 173009677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).