Chlorethoxy(methyl)silan

C3H7ClOSi — CID 54432940

IUPAC—
SMILESC[Si]OCCCl
InChIInChI=1S/C3H7ClOSi/c1-6-5-3-2-4/h2-3H2,1H3
InChIKeyQDKQXDICHLCNNE-UHFFFAOYSA-N
MW122.63 g/mol
LogP0.91
Rot. Bonds3

About Chlorethoxy(methyl)silan

Chlorethoxy(methyl)silan (PubChem CID 54432940) has the molecular formula C3H7ClOSi and a molecular weight of 122.63 g/mol.

Molecular Properties

Compound NameChlorethoxy(methyl)silan
PubChem CID54432940
Molecular FormulaC3H7ClOSi
Molecular Weight122.63 g/mol
Exact Mass122.00
IUPAC Name—
SMILESC[Si]OCCCl
InChIInChI=1S/C3H7ClOSi/c1-6-5-3-2-4/h2-3H2,1H3
InChIKeyQDKQXDICHLCNNE-UHFFFAOYSA-N
XLogP0.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.63
LogP ≤ 50.91
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-Chloroethoxytrimethylsilane
CID 262823
(2-Chloroethoxy)(dimethyl)silane
CID 55302623
CID 18987808
CID 18987808
[(2-Chloroethoxy)methyl]silane
CID 19958115
CID 87293676
CID 87293676
(Chloromethyl)ethoxysilane
CID 87878862
CID 87479310
CID 87479310
2-Chloroethoxy(methyl)silane
CID 148919149
(1-Chloroethoxy)silane
CID 23045874

Frequently Asked Questions

What is the IUPAC name of Chlorethoxy(methyl)silan?
The IUPAC name of Chlorethoxy(methyl)silan (CID 54432940) is not available.
What is the SMILES notation for Chlorethoxy(methyl)silan?
The canonical SMILES for Chlorethoxy(methyl)silan is C[Si]OCCCl.
What is the InChIKey of Chlorethoxy(methyl)silan?
The InChIKey is QDKQXDICHLCNNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7ClOSi/c1-6-5-3-2-4/h2-3H2,1H3.
What are the key properties of Chlorethoxy(methyl)silan?
Chlorethoxy(methyl)silan has a molecular weight of 122.63 g/mol, XLogP of 0.91, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for Chlorethoxy(methyl)silan is sourced from PubChem (CID 54432940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).