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Safety Information

559199

Sigma-Aldrich

Ethyl (4-iodobenzoyl)acetate

95%

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About This Item

Linear Formula:
IC6H4COCH2CO2C2H5
CAS Number:
Molecular Weight:
318.11
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:

Assay

95%

refractive index

n20/D 1.6070 (lit.)

density

1.609 g/mL at 25 °C (lit.)

functional group

ester
iodo
ketone

SMILES string

CCOC(=O)CC(=O)c1ccc(I)cc1

InChI

1S/C11H11IO3/c1-2-15-11(14)7-10(13)8-3-5-9(12)6-4-8/h3-6H,2,7H2,1H3

InChI key

DOIUIJYPQHAHLM-UHFFFAOYSA-N

Application

Reactant for:
  • Synthesis of trisubstituted pyrroles via rearrangement reactions catalyzed by Ir catalyst
  • Preparation of biologically active molecules

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

ISHL Indicated Name

Substances Subject to be Indicated Names

ISHL Notified Names

Substances Subject to be Notified Names

JAN Code

559199-1G:4548173994918
559199-BULK:
559199-VAR:
559199-5G:4548173994925


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