2-Bromo-4,5,6,7-tetrahydro-1-benzothiophene

Modify Date: 2025-10-12 16:03:23

2-Bromo-4,5,6,7-tetrahydro-1-benzothiophene Structure
2-Bromo-4,5,6,7-tetrahydro-1-benzothiophene structure
Common Name 2-Bromo-4,5,6,7-tetrahydro-1-benzothiophene
CAS Number 111873-07-5 Molecular Weight 217.126
Density 1.5±0.1 g/cm3 Boiling Point 273.1±40.0 °C at 760 mmHg
Molecular Formula C8H9BrS Melting Point N/A
MSDS N/A Flash Point 119.0±27.3 °C

 Names

Name 2-Bromo-4,5,6,7-tetrahydro-1-benzothiophene
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.5±0.1 g/cm3
Boiling Point 273.1±40.0 °C at 760 mmHg
Molecular Formula C8H9BrS
Molecular Weight 217.126
Flash Point 119.0±27.3 °C
Exact Mass 215.960831
PSA 28.24000
LogP 4.43
Vapour Pressure 0.0±0.5 mmHg at 25°C
Index of Refraction 1.609
InChIKey CJRRLCPMBQMCRO-UHFFFAOYSA-N
SMILES Brc1cc2c(s1)CCCC2

 Synthetic Route

~86%

2-Bromo-4,5,6,7-tetrahydro-1-benzothiophene Structure

2-Bromo-4,5,6,7...

CAS#:111873-07-5

Literature: GENENTECH, INC. Patent: WO2009/151598 A1, 2009 ; Location in patent: Page/Page column 146-147 ; WO 2009/151598 A1

 Synonyms

Benzo[b]thiophene, 2-bromo-4,5,6,7-tetrahydro-
2-Bromo-4,5,6,7-tetrahydro-1-benzothiophene
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