1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone

Modify Date: 2025-09-03 21:13:57

1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone Structure
1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone structure
Common Name 1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone
CAS Number 866545-96-2 Molecular Weight 239.069
Density 1.7±0.1 g/cm3 Boiling Point 384.1±37.0 °C at 760 mmHg
Molecular Formula C9H7BrN2O Melting Point N/A
MSDS N/A Flash Point 186.1±26.5 °C

 Names

Name 1-(5-Bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.7±0.1 g/cm3
Boiling Point 384.1±37.0 °C at 760 mmHg
Molecular Formula C9H7BrN2O
Molecular Weight 239.069
Flash Point 186.1±26.5 °C
Exact Mass 237.974167
PSA 45.75000
LogP 2.76
Vapour Pressure 0.0±0.9 mmHg at 25°C
Index of Refraction 1.686
InChIKey AYSQNMFURHMHBB-UHFFFAOYSA-N
SMILES CC(=O)c1c[nH]c2ncc(Br)cc12

 Safety Information

Hazard Codes Xi
HS Code 2933990090

 Synthetic Route

~10%

1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone Structure

1-(5-bromo-1H-p...

CAS#:866545-96-2

Literature: Hong, Seunghee; Lee, Soyoung; Kim, Bomi; Lee, Hyunseung; Hong, Soon-Sun; Hong, Sungwoo Bioorganic and Medicinal Chemistry Letters, 2010 , vol. 20, # 24 p. 7212 - 7215

~91%

1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone Structure

1-(5-bromo-1H-p...

CAS#:866545-96-2

Literature: VERTEX PHARMACEUTICALS INCORPORATED? Patent: WO2005/95400 A1, 2005 ; Location in patent: Page/Page column 330; 331 ; WO 2005/095400 A1

 Precursor & DownStream

Precursor  2

DownStream  0

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

3-Acetyl-5-bromo-7-azaindole
ETHANONE,1-(5-BROMO-1H-PYRROLO[2,3-B]PYRIDIN-3-YL)
Ethanone, 1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-
1-(5-bromo-1H-pyrrolo[2,3-b]pyridine-3-yl)-ethanone
1-(5-BROMO-7-AZAINDOLE)ETHANONE
1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-ethanone
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