[(2-Chloroethoxy)methyl]silane

C3H6ClOSi — CID 19958115

IUPAC—
SMILES[Si]COCCCl
InChIInChI=1S/C3H6ClOSi/c4-1-2-5-3-6/h1-3H2
InChIKeyUKWBZRLBBJESRH-UHFFFAOYSA-N
MW121.62 g/mol
LogP0.37
Rot. Bonds3

About [(2-Chloroethoxy)methyl]silane

[(2-Chloroethoxy)methyl]silane (PubChem CID 19958115) has the molecular formula C3H6ClOSi and a molecular weight of 121.62 g/mol.

Molecular Properties

Compound Name[(2-Chloroethoxy)methyl]silane
PubChem CID19958115
Molecular FormulaC3H6ClOSi
Molecular Weight121.62 g/mol
Exact Mass120.99
IUPAC Name—
SMILES[Si]COCCCl
InChIInChI=1S/C3H6ClOSi/c4-1-2-5-3-6/h1-3H2
InChIKeyUKWBZRLBBJESRH-UHFFFAOYSA-N
XLogP0.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.62
LogP ≤ 50.37
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

2,2-Dichloroethoxymethylsilane
CID 71353263
2-Chloroethoxymethylsilane
CID 71349699
1-Chloroethoxymethylsilane
CID 123635282
1,2-Dichloroethoxymethylsilane
CID 123682182
2-Chloroethoxy(methyl)silane
CID 148919149
(2-Chloro-1-methoxyethyl)silane
CID 173009677
CID 173009683
CID 173009683
2-(2-Chloroethoxy)ethylsilane
CID 173982580

Frequently Asked Questions

What is the IUPAC name of [(2-Chloroethoxy)methyl]silane?
The IUPAC name of [(2-Chloroethoxy)methyl]silane (CID 19958115) is not available.
What is the SMILES notation for [(2-Chloroethoxy)methyl]silane?
The canonical SMILES for [(2-Chloroethoxy)methyl]silane is [Si]COCCCl.
What is the InChIKey of [(2-Chloroethoxy)methyl]silane?
The InChIKey is UKWBZRLBBJESRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6ClOSi/c4-1-2-5-3-6/h1-3H2.
What are the key properties of [(2-Chloroethoxy)methyl]silane?
[(2-Chloroethoxy)methyl]silane has a molecular weight of 121.62 g/mol, XLogP of 0.37, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-Chloroethoxy)methyl]silane is sourced from PubChem (CID 19958115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).