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Merck
CN

560197

3-Bromo-4-methoxyphenethylamine

97%

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About This Item

Linear Formula:
BrC6H3(OCH3)(CH2CH2NH2)
CAS Number:
Molecular Weight:
230.10
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
97%
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Quality Level

assay

97%

refractive index

n20/D >1.5800 (lit.)

density

1.389 g/mL at 25 °C (lit.)

functional group

amine, bromo

SMILES string

COc1ccc(CCN)cc1Br

InChI

1S/C9H12BrNO/c1-12-9-3-2-7(4-5-11)6-8(9)10/h2-3,6H,4-5,11H2,1H3

InChI key

JHVALSRTUOVNLL-UHFFFAOYSA-N

General description

3-Bromo-4-methoxyphenethylamine can be synthesized by reacting N-benzoyl-3-bromo-4-methoxyphenethylamine, acetic acid and HCl in the presence of N2.

Application

3-Bromo-4-methoxyphenethylamine (3-Bromo-4-methoxy-β-phenethylamine) may be used as a starting reagent in the synthesis of 3-bromo-4-methoxy-5-nitro-β-phenethylamine. It may also be used to synthesize 4-bromo-N-(3-bromo-4-methoxyphenethyl)-1H-pyrrole-2-carboxamide.


signalword

Danger

Storage Class

8A - Combustible corrosive hazardous materials

flash_point_f

230.0 °F - closed cup

flash_point_c

110 °C - closed cup

ppe

Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter

pictograms

CorrosionExclamation mark

hcodes

Hazard Classifications

Acute Tox. 4 Oral - Eye Dam. 1 - Skin Corr. 1B



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Synthesis of Aminoisoquinolines and Related Compounds. X. A Modified Synthesis of dl-Cularine.
Ishiwata S, et al.
Chemical & Pharmaceutical Bulletin, 18(9), 1850-1855 (1970)
Kumar Saurav et al.
Marine drugs, 18(2) (2020-02-26)
Marine sponges, a well-documented prolific source of natural products, harbor highly diverse microbial communities. Their extracts were previously shown to contain quorum sensing (QS) signal molecules of the N-acyl homoserine lactone (AHL) type, known to orchestrate bacterial gene regulation. Some
Syntheses of the marine metabolites verongamine, hemibastadin-2, and aerothionin using the cyano ylide coupling methodology.
Wasserman HH and Wang J.
The Journal of Organic Chemistry, 63(16), 5581-5586 (1998)



Global Trade Item Number

SKUGTIN
560197-5G04061836821678