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Key Documents

433098

Sigma-Aldrich

5-Bromo-1-indanone

97%

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About This Item

Empirical Formula (Hill Notation):
C9H7BrO
CAS Number:
Molecular Weight:
211.06
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Assay

97%

mp

126-129 °C (lit.)

SMILES string

Brc1ccc2C(=O)CCc2c1

InChI

1S/C9H7BrO/c10-7-2-3-8-6(5-7)1-4-9(8)11/h2-3,5H,1,4H2

InChI key

KSONICAHAPRCMV-UHFFFAOYSA-N

General description

5-Bromo-1-indanone is a 1-indanone derivative. Its physical properties like density, freezing point and refractive index have been determined. It participates in the synthesis of the imidazolyl and triazolyl substituted biphenyl compounds.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Classifications

Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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Dawei Ma et al.
The Journal of organic chemistry, 64(1), 120-125 (2001-10-25)
Heating a mixture of alpha-aryl ketone with (R)-phenylglycinol produces a mixture of imine and 1,3-dioxazolidine. Treatment of this mixture with trimethylsilyl cyanide followed by transformation of nitrile to ester gives Strecker-type reaction products. The diastereoselectivity of the generated alpha-amino esters
Andrew K Takle et al.
Bioorganic & medicinal chemistry letters, 16(2), 378-381 (2005-11-02)
A novel triarylimidazole derivative, SB-590885 (33), bearing a 2,3-dihydro-1H-inden-1-one oxime substituent has been identified as a potent and extremely selective inhibitor of B-Raf kinase.
Agustin Casimiro-Garcia et al.
Journal of medicinal chemistry, 54(12), 4219-4233 (2011-05-12)
Mining of an in-house collection of angiotensin II type 1 receptor antagonists to identify compounds with activity at the peroxisome proliferator-activated receptor-γ (PPARγ) revealed a new series of imidazo[4,5-b]pyridines 2 possessing activity at these two receptors. Early availability of the
Turn-On Fluorogenic Probes for the Selective and Quantitative Detection of the Cyanide Anion from Natural Sources.
Gomez T, et al.
Chemistry (Weinheim An Der Bergstrasse, Germany), 8(6), 1271-1278 (2013)
Brian E Fink et al.
Bioorganic & medicinal chemistry letters, 16(6), 1532-1536 (2006-01-03)
A novel series of 17beta-hydroxysteroid dehydrogenase type 3 (17beta-HSD3) inhibitors has been identified. These inhibitors, based on a dibenzazocine core, exhibited picomolar to low nanomolar inhibition of 17beta-HSD3 in cell-free enzymatic as well as in cell-based transcriptional reporter assays.

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