Product Name

  • Name

    N-(Dibenzothiophen-2-yl)acetamide

  • EINECS
  • CAS No. 54818-88-1
  • Article Data6
  • CAS DataBase
  • Density 1.338g/cm3
  • Solubility
  • Melting Point
  • Formula C14H11NOS
  • Boiling Point 507.5°Cat760mmHg
  • Molecular Weight 241.32
  • Flash Point 260.7°C
  • Transport Information
  • Appearance
  • Safety Questionable carcinogen with experimental carcinogenic data. When heated to decomposition it emits very toxic fumes of SOx and NOx.
  • Risk Codes
  • Molecular Structure Molecular Structure of 54818-88-1 (N-(Dibenzothiophen-2-yl)acetamide)
  • Hazard Symbols
  • Synonyms 2-acetamidodibenzothiophene;N-Dibenzothiophen-2-yl-acetamid;N-2-DIBENZOTHIENYLACETAMIDE;N-dibenzothiophen-2-yl-acetamide;
  • PSA 57.34000
  • LogP 4.08590

N-2-Dibenzothienylacetamide Chemical Properties

Molecule structure of N-2-Dibenzothienylacetamide (CAS NO.54818-88-1):

IUPAC Name: N-Dibenzothiophen-2-ylacetamide 
Molecular Weight: 241.30824 g/mol
Molecular Formula: C14H11NOS 
Density: 1.338 g/cm3 
Boiling Point: 507.5 °C at 760 mmHg 
Flash Point: 260.7 °C
Index of Refraction: 1.765
Molar Refractivity: 74.59 cm3
Molar Volume: 180.2 cm3
Polarizability: 29.57×10-24 cm3
Surface Tension: 60.1 dyne/cm 
Enthalpy of Vaporization: 77.76 kJ/mol
Vapour Pressure: 2.03E-10 mmHg at 25 °C
XLogP3: 3.6
H-Bond Donor: 1
H-Bond Acceptor: 1
Rotatable Bond Count: 1
Tautomer Count: 2
Exact Mass: 241.056135
MonoIsotopic Mass: 241.056135
Topological Polar Surface Area: 29.1
Heavy Atom Count: 17
Complexity: 307
Canonical SMILES: CC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C32
InChI: InChI=1S/C14H11NOS/c1-9(16)15-10-6-7-14-12(8-10)11-4-2-3-5-13(11)17-14/h2-8H,1H3,(H,15,16)
InChIKey of N-2-Dibenzothienylacetamide (CAS NO.54818-88-1): FBHBFAPHAYSMFP-UHFFFAOYSA-N

N-2-Dibenzothienylacetamide Safety Profile

Questionable carcinogen with experimental carcinogenic data. When heated to decomposition it emits very toxic fumes of SOx and NOx.

N-2-Dibenzothienylacetamide Specification

 N-2-Dibenzothienylacetamide (CAS NO.54818-88-1) is also named as 2-Acetylaminodibenzothiophene ; 4-18-00-07187 (Beilstein Handbook Reference) ; BRN 0192545 ; Acetamide, N-2-dibenzothienyl- .

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