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775789

8-Bromocaffeine

Name: 8-Bromocaffeine
Brand: ALDRICH

98%

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About This Item

Empirical Formula (Hill Notation):

C₈H₉BrN₄O₂

CAS Number:

10381-82-5

Molecular Weight:

273.09

NACRES:

NA.22

PubChem Substance ID:

329767788

UNSPSC Code:

12352005

MDL number:

MFCD00091929

Assay:

98%

Form:

solid

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Properties

assay

98%

form

solid

mp

208-210 °C

functional group

bromo

SMILES string

CN1C(=O)N(C)c2nc(Br)n(C)c2C1=O

InChI

1S/C8H9BrN4O2/c1-11-4-5(10-7(11)9)12(2)8(15)13(3)6(4)14/h1-3H3

InChI key

YRLRORFORQUTKS-UHFFFAOYSA-N

Description

Application

Promotes the conversion of aldoximes to nitriles under mildly basic conditions.

pictograms

GHS07

signalword

Warning

hcodes

H302

Hazard Classifications

Acute Tox. 4 Oral

Storage Class

13 - Non Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

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