chempirical

(3-Chloropropyl)diethoxymethylsilane

C8H19ClO2SiCAS 13501-76-3210.77 g/mol

Open in Covalent MOL file
OSiClO
Alkyl halideSilyl ether

Properties

Molecular formula
C8H19ClO2Si
Molar mass
210.77 g/mol
Exact mass
210.0843 Da
Density
0.9744 g/mL (at 20 °C)
Boiling point
81–83 °C (at 8 Torr)
logP
2.76Crippen estimate
Polar surface area
18.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
7

Identifiers

CAS number
13501-76-3
SMILES
CCO[Si](C)(CCCCl)OCC
InChIKey
KEZMLECYELSZDC-UHFFFAOYSA-N
InChI
InChI=1S/C8H19ClO2Si/c1-4-10-12(3,11-5-2)8-6-7-9/h4-8H2,1-3H3

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Names and synonyms

6 names
  • Silane, (3-chloropropyl)diethoxymethyl-
  • 3-Chloropropylmethyldiethoxysilane
  • (γ-Chloropropyl)diethoxymethylsilane
  • DB 220
  • YDH 701
  • FX-M 01868

Work with (3-Chloropropyl)diethoxymethylsilane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(3-Chloropropyl)triethoxysilane5089-70-363 % similar γ-Aminopropylmethyldiethoxysilane3179-76-859 % similar (3-Chloropropyl)dimethoxymethylsilane18171-19-257 % similar (Chloromethyl)diethoxymethylsilane2212-10-456 % similar γ-Glycidoxypropylmethyldiethoxysilane2897-60-147 % similar 1,3-Bis(3-chloropropyl)-1,1,3,3-tetramethyldisiloxane18132-72-445 % similar (3-Chloropropyl)trimethylsilane2344-83-444 % similar 3-(3-Chloropropyl)-1,1,1,5,5,5-hexamethyl-3-[(trimethylsilyl)oxy]trisiloxane18077-31-142 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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