5-Hexenyltrichlorosilane

C₆H₁₁Cl₃SiCAS 18817-29-3217.59 g/mol

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Alkene

Properties

Molecular formula: C₆H₁₁Cl₃Si
Molar mass: 217.59 g/mol
Exact mass: 215.9696 Da
logP: 4.00Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 5

Hazards

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

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Identifiers

CAS number

18817-29-3

SMILES

C=CCCCC[Si](Cl)(Cl)Cl

InChIKey

IHYCWJYGNRZAOB-UHFFFAOYSA-N

InChI

InChI=1S/C6H11Cl3Si/c1-2-3-4-5-6-10(7,8)9/h2H,1,3-6H2

Characterization data

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

¹H NMR

Predicted ¹H NMR (400 MHz, CDCl₃) δ 5.70 (ddt, J = 16.8, 10.8, 6.8 Hz, 1H), 5.03 (dd, J = 16.8, 1.4 Hz, 1H), 4.97 (dd, J = 10.8, 1.4 Hz, 1H), 2.04 (q, J = 6.9 Hz, 2H), 1.37 (quint, J = 7.0 Hz, 2H), 1.22 (quint, J = 7.0 Hz, 2H), 0.50 (t, J = 7.0 Hz, 2H).

¹³C NMR

Predicted ¹³C NMR (101 MHz, CDCl₃) δ 140.5, 113.5, 33.2, 31.2, 25.2, 16.4.

[M + H]+

[M + H]+ Calcd for C6H12Cl3Si 216.9768

[M + Na]+

[M + Na]+ Calcd for C6H11Cl3NaSi 238.9588

[M − H]−

[M − H]− Calcd for C6H10Cl3Si 214.9623

Elemental analysis

Anal. Calcd for C6H11Cl3Si: C, 33.12; H, 5.10.