5-Bromo-1-benzothiophene-3-carbaldehyde

Modify Date: 2025-08-25 12:18:33

5-Bromo-1-benzothiophene-3-carbaldehyde Structure
5-Bromo-1-benzothiophene-3-carbaldehyde structure
Common Name 5-Bromo-1-benzothiophene-3-carbaldehyde
CAS Number 16296-72-3 Molecular Weight 241.10400
Density 1.711g/cm3 Boiling Point 360.5ºC at 760mmHg
Molecular Formula C9H5BrOS Melting Point 106ºC
MSDS N/A Flash Point 171.8ºC

 Names

Name 5-bromo-1-benzothiophene-3-carbaldehyde
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.711g/cm3
Boiling Point 360.5ºC at 760mmHg
Melting Point 106ºC
Molecular Formula C9H5BrOS
Molecular Weight 241.10400
Flash Point 171.8ºC
Exact Mass 239.92400
PSA 45.31000
LogP 3.47630
Vapour Pressure 2.21E-05mmHg at 25°C
Index of Refraction 1.741
InChIKey LQLMHAYNFMAEHI-UHFFFAOYSA-N
SMILES O=Cc1csc2ccc(Br)cc12

 Safety Information

Hazard Codes Xn
HS Code 2934999090

 Synthetic Route

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5-Bromo-1-benzothiophene-3-carbaldehyde Structure

5-Bromo-1-benzo...

CAS#:16296-72-3

Literature: US2006/47001 A1, ; Page/Page column 14 ;

 Customs

HS Code 2934999090
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 5-Bromo-1-benzothiophene-3-carbaldehydeBioassay

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Name: Inhibition of human CYP2A6 in baculovirus-infected insect cell system using coumarin ...
Source: ChEMBL
Target: Cytochrome P450 2A6
External Id: CHEMBL3390302
Name: Irreversible inhibition of human CYP2A6 in baculovirus-infected insect cell system us...
Source: ChEMBL
Target: Cytochrome P450 2A6
External Id: CHEMBL3390304
Name: Inhibition of human CYP2A6 in baculovirus-infected insect cell system using coumarin ...
Source: ChEMBL
Target: Cytochrome P450 2A6
External Id: CHEMBL3390303
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 Synonyms

5-bromo-benzothiophene-3-carboxaldehyde
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