Product Name

  • Name

    Thiocyanatoacetic acid propyl ester

  • EINECS
  • CAS No. 5349-21-3
  • Density 1.15g/cm3
  • Solubility
  • Melting Point
  • Formula C6H9NO2S
  • Boiling Point 241.2°C at 760 mmHg
  • Molecular Weight 159.209
  • Flash Point 99.7°C
  • Transport Information
  • Appearance
  • Safety A poison by intraperitoneal route. When heated to decomposition it emits toxic vapors of NOx and SOx.
  • Risk Codes
  • Molecular Structure Molecular Structure of 5349-21-3 (Thiocyanatoacetic acid propyl ester)
  • Hazard Symbols
  • Synonyms Thiocyano-essigsaeure-N-propyl-ester;Thiocyano-essigsaeure-N-propyl-ester [German];Thiocyanatoacetic acid propyl ester;ACETIC ACID,THIOCYANATO-,PROPYL ESTER;Propyl thiocyanatoacetate;
  • PSA 75.39000
  • LogP 1.15388

Thiocyanatoacetic acid propyl ester Chemical Properties

IUPAC Name: Propyl 2-thiocyanatoacetate
Molecular Formula: C6H9NO2S
Molecular Weight: 159.22g/mol 
Freely Rotating Bonds: 5
Polar Surface Area: 75.39 Å2
Index of Refraction: 1.483
Molar Refractivity: 39.53 cm3
Molar Volume: 138.4 cm3
Polarizability: 15.67 ×10-24cm3
Surface Tension: 43 dyne/cm
Density: 1.15 g/cm3
Flash Point: 99.7 °C
Enthalpy of Vaporization: 47.82 kJ/mol
Boiling Point: 241.2 °C at 760 mmHg
Vapour Pressure: 0.0363 mmHg at 25°C
 The Cas Register Number of Thiocyanatoacetic acid propyl ester is 5349-21-3 .The chemical synonyms of Thiocyanatoacetic acid propyl ester (CAS No.5349-21-3 ) are Thiocyanatoacetic acid propyl ester .The molecular structure of Thiocyanatoacetic acid propyl ester (CAS No.5349-21-3 ) is.

Thiocyanatoacetic acid propyl ester Uses

It can be used in organic synthesis.

Thiocyanatoacetic acid propyl ester Toxicity Data With Reference

1.    

ipr-rat LDLo:40 mg/kg

    ARZNAD    Arzneimittel-Forschung. Drug Research. 16 (1966),870.

Thiocyanatoacetic acid propyl ester Safety Profile

A poison by intraperitoneal route. When heated to decomposition it emits toxic vapors of NOx and SOx.

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