(Chloromethyl)dimethylethylsilane

C5H13ClSiCAS 3121-77-5136.69 g/mol

SiCl
Alkyl halide

Properties

Molecular formula
C5H13ClSi
Molar mass
136.69 g/mol
Exact mass
136.0475 Da
logP
2.49Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

Identifiers

CAS number
3121-77-5
SMILES
CC[Si](C)(C)CCl
InChIKey
BCZCLPJVTSRZLR-UHFFFAOYSA-N
InChI
InChI=1S/C5H13ClSi/c1-4-7(2,3)5-6/h4-5H2,1-3H3
Characterization data

Calculated from the structure, in the form journals print them.

¹H NMR
Predicted ¹H NMR (400 MHz, CDCl₃) δ 2.91 (s, 2H), 0.81 (t, J = 7.0 Hz, 3H), 0.50 (q, J = 7.0 Hz, 2H), 0.00 (s, 6H).
¹³C NMR
Predicted ¹³C NMR (101 MHz, CDCl₃) δ 30.7, 9.1, 8.8, 0.0.
[M + H]+
[M + H]+ Calcd for C5H14ClSi 137.0548
[M + Na]+
[M + Na]+ Calcd for C5H13ClNaSi 159.0367
[M − H]−
[M − H]− Calcd for C5H12ClSi 135.0402
Elemental analysis
Anal. Calcd for C5H13ClSi: C, 43.93; H, 9.59.

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Type any one amount. The others follow from the molar mass.

Work with (Chloromethyl)dimethylethylsilane

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

Same formula

Elsewhere