5381-20-4

Name 1-Benzothiophene-3-carbaldehyde
CAS 5381-20-4
EINECS(EC#) 611-051-9
Molecular Formula C9H6OS
MDL Number MFCD00052376
Molecular Weight 162.21
MOL File 5381-20-4.mol
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Chemical Properties

Appearance Yellow to brown crystalline powder
Melting point  53-57 °C (lit.)
Boiling point  166 °C/20 mmHg (lit.)
density  1.2123 (rough estimate)
refractive index  1.5500 (estimate)
Fp  >230 °F
storage temp.  under inert gas (nitrogen or Argon) at 2–8 °C
form  powder to crystal
color  White to Orange to Green
λmax 302nm(EtOH)(lit.)
InChI 1S/C9H6OS/c10-5-7-6-11-9-4-2-1-3-8(7)9/h1-6H
InChIKey WDJLPQCBTBZTRH-UHFFFAOYSA-N
SMILES O=Cc1csc2ccccc12
CAS DataBase Reference 5381-20-4(CAS DataBase Reference)

Safety Data

Hazard Codes  Xi
WGK Germany  3
Hazard Note  Irritant
HS Code  29349990
Storage Class 11 - Combustible Solids

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