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165190

O-Acetylsalicyloyl chloride

Name: <I>O</I>-Acetylsalicyloyl chloride
Brand: ALDRICH

95%

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About This Item

Linear Formula:

2-(CH₃CO₂)C₆H₄COCl

CAS Number:

5538-51-2

Molecular Weight:

198.60

UNSPSC Code:

12352100

NACRES:

NA.22

PubChem Substance ID:

24850129

EC Number:

226-899-1

Beilstein/REAXYS Number:

880372

MDL number:

MFCD00000663

Assay:

95%

Form:

solid

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Properties

Quality Segment

200

assay

95%

form

solid

refractive index

n20/D 1.536 (lit.)

bp

107-110 °C/0.1 mmHg (lit.)

mp

45-49 °C (lit.)

functional group

acyl chloride, ester

SMILES string

CC(=O)Oc1ccccc1C(Cl)=O

InChI

1S/C9H7ClO3/c1-6(11)13-8-5-3-2-4-7(8)9(10)12/h2-5H,1H3

InChI key

DSGKWFGEUBCEIE-UHFFFAOYSA-N

Description

Application

O-Acetylsalicyloyl chloride was used in the synthesis of enantiomerically pure bidentate heteroorganic ligands built on simple achiral skeletons and containing an aziridine moiety.
It was used in the general synthesis of acetoxybenzamides.
It was used in the chemical synthesis of 2,2,6,6-tetramethyl-1-piperidinyloxy(TEMPO)-aspirin conjugate via condensation reaction with 4-hydroxy-TEMPO.
It was used as reagent in acylation of cyclobutenediones.

pictograms

GHS05

signalword

Danger

hcodes

H314

pcodes

P260 - P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338 - P363

Hazard Classifications

Eye Dam. 1 - Skin Corr. 1B

Storage Class

8A - Combustible corrosive hazardous materials

wgk

WGK 3

flash_point_f

230.0 °F

flash_point_c

110 °C

ppe

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges

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