Product Name

  • Name

    Methyl[(methylthio)acetyl]carbamic acid o-isopropoxyphenyl ester

  • EINECS
  • CAS No. 17959-12-5
  • Density 1.178g/cm3
  • Solubility
  • Melting Point
  • Formula C14H19NO4S
  • Boiling Point 396.3°Cat760mmHg
  • Molecular Weight 297.40
  • Flash Point 193.5°C
  • Transport Information
  • Appearance
  • Safety Moderately toxic by ingestion. When heated to decomposition it emits very toxic fumes of SOx and NOx. See also CARBAMATES.
  • Risk Codes
  • Molecular Structure Molecular Structure of 17959-12-5 (Methyl[(methylthio)acetyl]carbamic acid o-isopropoxyphenyl ester)
  • Hazard Symbols
  • Synonyms ENT 27,351;2-Isopropoxyphenyl N-methylthioacetyl-N-methylcarbamat;
  • PSA 81.14000
  • LogP 2.79400

2-(1-Methylethoxy)phenyl methyl((methylthio)acetyl)carbamate Chemical Properties

The Molecular Structure of   2-(1-Methylethoxy)phenyl methyl((methylthio)acetyl)carbamate (CAS NO.17959-12-5):
Molecular Formula: C14H19NO4S
Molecular Weight: 297.369960 g/mol
IUPAC: (2-propan-2-yloxyphenyl) N-methyl-N-(2-methylsulfanylacetyl)carbamate
Density: 1.178 g/cm3
Flash Point: 193.5 °C
Enthalpy of Vaporization: 64.66 kJ/mol
Boiling Point: 396.3 °C at 760 mmHg
Vapour Pressure: 1.73E-06 mmHg at 25°C
ACD/LogP: 2.14 # of Rule of 5 Violations: 0
ACD/LogD (pH 5.5): 2.14 ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 5.5): 24.99 ACD/BCF (pH 7.4): 24.99
ACD/KOC (pH 5.5): 348.46 ACD/KOC (pH 7.4): 348.46 
Polar Surface Area: 81.14Å2
Index of Refraction: 1.539
Molar Refractivity: 79.14 cm3
Molar Volume: 252.3 cm3
Surface Tension: 42.2 dyne/cm

2-(1-Methylethoxy)phenyl methyl((methylthio)acetyl)carbamate Toxicity Data With Reference

1.    

orl-rat LD50:650 mg/kg

     ARSIM*    Agricultural Research Service, USDA Information Memorandum. 20 (1966),26.
2.    

orl-mus LD50:430 mg/kg

     ARSIM*    Agricultural Research Service, USDA Information Memorandum. 20 (1966),26.

2-(1-Methylethoxy)phenyl methyl((methylthio)acetyl)carbamate Safety Profile

Moderately toxic by ingestion. When heated to decomposition it emits very toxic fumes of SOx and NOx. See also CARBAMATES.

2-(1-Methylethoxy)phenyl methyl((methylthio)acetyl)carbamate Specification

  2-(1-Methylethoxy)phenyl methyl((methylthio)acetyl)carbamate (CAS NO.17959-12-5) is also called as BRN 1890490 ;  ENT27,351 ; NSC 190949 ; U-22023 ; Upjohn U-22023 ; Carbamic acid, methyl ((methylthio)acetyl)-, o-isopropoxyphenyl ester .
 

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