(S)-3-(4'-bromophenyl)-3-hydroxypropanenitrile

Base Information

Chemical Name:(S)-3-(4'-bromophenyl)-3-hydroxypropanenitrile
CAS No.:877876-70-5
Molecular Formula:C₉H₈BrNO
Molecular Weight:226.073
Hs Code.:

Synonyms:(S)-3-(4'-bromophenyl)-3-hydroxypropanenitrile

Suppliers and Price of (S)-3-(4'-bromophenyl)-3-hydroxypropanenitrile

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemicals and raw materials
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Total 1 raw suppliers

Chemical Property of (S)-3-(4'-bromophenyl)-3-hydroxypropanenitrile

Chemical Property:

Boiling Point:401.2±30.0 °C(Predicted)
Density:1.542±0.06 g/cm3(Predicted)

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

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Technology Process of (S)-3-(4'-bromophenyl)-3-hydroxypropanenitrile

There total 3 articles about (S)-3-(4'-bromophenyl)-3-hydroxypropanenitrile which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 93.0%

: 4592-94-3
3-(4-bromophenyl)-3-oxopropanenitrile

: 877876-70-5
(S)-3-(4'-bromophenyl)-3-hydroxypropanenitrile

Guidance literature:: With Almag CRED A₁₃₁; NADP; glucose dehydrogenase; In water; dimethyl sulfoxide; isopropyl alcohol; at 35 ℃; under 375.038 Torr; pH=7; Enzymatic reaction;
DOI:10.1016/j.tetasy.2013.09.015

Reference yield:

: 1122-91-4
4-bromo-benzaldehyde

: 75-05-8,26809-02-9
acetonitrile

: 877876-61-4
(R)-3-(4'-bromophenyl)-3-hydroxypropanenitrile

: 877876-70-5
(S)-3-(4'-bromophenyl)-3-hydroxypropanenitrile

Guidance literature:: With C₃₀H₂₆N₇NiO₂⁽¹⁺⁾*F₆P^(1-); potassium tert-butylate; In isopropyl alcohol; at -20 ℃; for 24h; Overall yield = 99 percent; Overall yield = 22.4 mg; enantioselective reaction; Inert atmosphere;
DOI:10.1002/anie.202016690

Reference yield:

: 5798-75-4
Ethyl 4-bromobenzoate

: 877876-70-5
(S)-3-(4'-bromophenyl)-3-hydroxypropanenitrile

Guidance literature:: Multi-step reaction with 2 steps

1: potassium 2-methylbutan-2-olate / tetrahydrofuran; toluene / 0.33 h / 20 °C / Inert atmosphere

2: formic acid; {Cp*Ir[(R,R)-Me-CF₃-DPEN](H₂O)}(SO₄) / methanol; water / 18 h / 70 °C / Inert atmosphere

With formic acid; {Cp*Ir[(R,R)-Me-CF₃-DPEN](H₂O)}(SO₄); potassium 2-methylbutan-2-olate; In tetrahydrofuran; methanol; water; toluene;
DOI:10.1002/anie.201102732