ChemicalBook--->CAS DataBase List--->176707-77-0

176707-77-0

176707-77-0 Structure

176707-77-0 Structure
IdentificationBack Directory
[Name]

(R)-1-(3-Bromophenyl)ethylamine
[CAS]

176707-77-0
[Synonyms]

Albb-005066
(R)-3-Bromo-α
?-1-(3-Bromophenyl)ethanamine
(R)-3-Bromo-α-methylbenzylamine
(R)-1-(3-BROMOPHENYL)ETHANAMINE
(R)-1-(3-BROMOPHENYL)ETHYLAMINE
[(1R)-1-(3-Bromophenyl)ethyl]amine
(R)-1-(3-bromophenyl)ethan-1-amine
(R)-3-BROMO-ALPHA-METHYLBENZYLAMINE
(R)-(+)-3-BROMO A-METHYLBENZYLAMINE
(R)-3-BroMo-α-MethylbenzylaMine
Benzenemethanamine, 3-bromo-α-methyl-, (αR)-
(1R)-1-(3-bromophenyl)ethanamine(SALTDATA: FREE)
(R)-1-(3-Bromophenyl)ethylamine, ChiPros 99%, ee 98+%
Benzenemethanamine, 3-bromo-.alpha.-methyl-, (.alpha.R)-
(R)-1-(3-BroMophenyl)ethylaMine, ChiPros|r, 99%, ee 98+%
[Molecular Formula]

C8H10BrN
[MDL Number]

MFCD00671637
[MOL File]

176707-77-0.mol
[Molecular Weight]

200.08
Chemical PropertiesBack Directory
[Boiling point ]

96°C/4mm
[density ]

1.33
[Fp ]

96°C/4mm
[storage temp. ]

under inert gas (nitrogen or Argon) at 2–8 °C
[pka]

8.73±0.10(Predicted)
[Appearance]

Colorless to light yellow Liquid
[Optical Rotation]

Consistent with structure
[Sensitive ]

Air Sensitive
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)Exclamation Mark (GHS07)Environment (GHS09)
GHS05,GHS07,GHS09
[Signal word ]

Danger
[Hazard statements ]

H318-H302-H314-H317-H411
[Precautionary statements ]

P273-P280-P305+P351+P338-P310-P303+P361+P353
[Hazard Codes ]

C,N
[Risk Statements ]

34-51/53-43-22
[Safety Statements ]

26-36/37/39-61-45
[RIDADR ]

2735
[HazardClass ]

8
[PackingGroup ]

III
Spectrum DetailBack Directory
[Spectrum Detail]

(R)-1-(3-Bromophenyl)ethylamine(176707-77-0)1HNMR
Hazard InformationBack Directory
[Synthesis]

Ethanone, 1-(3-bromophenyl)-, oxime

24280-05-5

(R)-1-(3-Bromophenyl)ethylamine

176707-77-0

The general procedure for the synthesis of (R)-1-(3-bromophenyl)ethylamine from 1-(3-bromophenyl)ethanone oxime is as follows: 1 equiv. of N-[1-(3-bromophenyl)ethylidene]hydroxylamine, 5 mol% of RuCl(Cymene)(S-tol-Binap)Cl catalyst, 5 equiv. of additives, and 70 vol. of methanol (relative to the amount of the oxime) are added to a glass vial. The glass vials were placed in a parallel autoclave, which was pressurized to 30 bar with hydrogen, then heated to 90 °C and kept for 24 hours. After completion of the reaction, the system was cooled to 20 °C. The reaction mixture was diluted with isopropyl alcohol. The reaction mixture was diluted with isopropanol and analyzed by chiral HPLC.

[References]

[1] Patent: WO2015/178847, 2015, A1. Location in patent: Page/Page column 7-8
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