4-chlorobutyl(dimethoxymethyl)silane

C7H17ClO2Si — CID 123272200

IUPAC4-chlorobutyl(dimethoxymethyl)silane
SMILESCOC(OC)[SiH2]CCCCCl
InChIInChI=1S/C7H17ClO2Si/c1-9-7(10-2)11-6-4-3-5-8/h7H,3-6,11H2,1-2H3
InChIKeyGSPICUHEZZQIQX-UHFFFAOYSA-N
MW196.75 g/mol
LogP1.17
Rot. Bonds7

About 4-chlorobutyl(dimethoxymethyl)silane

4-chlorobutyl(dimethoxymethyl)silane (PubChem CID 123272200) has the molecular formula C7H17ClO2Si and a molecular weight of 196.75 g/mol. Its IUPAC name is 4-chlorobutyl(dimethoxymethyl)silane.

Molecular Properties

Compound Name4-chlorobutyl(dimethoxymethyl)silane
PubChem CID123272200
Molecular FormulaC7H17ClO2Si
Molecular Weight196.75 g/mol
Exact Mass196.07
IUPAC Name4-chlorobutyl(dimethoxymethyl)silane
SMILESCOC(OC)[SiH2]CCCCCl
InChIInChI=1S/C7H17ClO2Si/c1-9-7(10-2)11-6-4-3-5-8/h7H,3-6,11H2,1-2H3
InChIKeyGSPICUHEZZQIQX-UHFFFAOYSA-N
XLogP1.17
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.75
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

dimethoxymethyl-[7-(dimethoxymethylsilyl)-4-[3-(dimethoxymethylsilyl)propyl]-4-silyloxyheptyl]silane
CID 123584726
dimethoxymethyl-[6-(dimethoxymethylsilyl)hexan-2-yl]silane
CID 123871036
dimethoxymethyl(propyl)silane;hydrate
CID 162311289
3-(dimethoxymethylsilyl)propyl carbamate
CID 123703912
bis[3-(dimethoxymethylsilyl)propyl] oxirane-2,3-dicarboxylate
CID 71331307
N'-[2-(dimethoxymethylsilyl)ethyl]ethane-1,2-diamine
CID 3017669
2-[3-(dimethoxymethylsilyl)propyl]butanedioic acid
CID 150817687
[4-[3-(dimethoxymethylsilyl)propyl]piperazin-1-yl]-trimethylsilane
CID 123723061
1-chloro-4-methoxyheptane
CID 102547593
(4S)-1-chloro-4-methoxyheptane
CID 97035520
dimethoxymethyl-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl]silane
CID 71337880
tris(dimethoxymethylsilylmethyl)-methylsilane
CID 123487432

Frequently Asked Questions

What is the IUPAC name of 4-chlorobutyl(dimethoxymethyl)silane?
The IUPAC name of 4-chlorobutyl(dimethoxymethyl)silane (CID 123272200) is 4-chlorobutyl(dimethoxymethyl)silane.
What is the SMILES notation for 4-chlorobutyl(dimethoxymethyl)silane?
The canonical SMILES for 4-chlorobutyl(dimethoxymethyl)silane is COC(OC)[SiH2]CCCCCl.
What is the InChIKey of 4-chlorobutyl(dimethoxymethyl)silane?
The InChIKey is GSPICUHEZZQIQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17ClO2Si/c1-9-7(10-2)11-6-4-3-5-8/h7H,3-6,11H2,1-2H3.
What are the key properties of 4-chlorobutyl(dimethoxymethyl)silane?
4-chlorobutyl(dimethoxymethyl)silane has a molecular weight of 196.75 g/mol, XLogP of 1.17, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chlorobutyl(dimethoxymethyl)silane is sourced from PubChem (CID 123272200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).