Product Name

  • Name

    DIETHYLDITHIOCARBAMIC ACID 2-BENZOTHIAZOLYL ESTER

  • EINECS 202-408-6
  • CAS No. 95-30-7
  • Article Data11
  • CAS DataBase
  • Density 1.315 g/cm3
  • Solubility
  • Melting Point 79 °C
  • Formula C12H14N2S3
  • Boiling Point 391.273 °C at 760 mmHg
  • Molecular Weight 282.455
  • Flash Point 190.435 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 95-30-7 (DIETHYLDITHIOCARBAMIC ACID 2-BENZOTHIAZOLYL ESTER)
  • Hazard Symbols
  • Synonyms Carbamic acid,diethyldithio-, 2-benzothiazolyl ester (6CI,7CI,8CI);Carbamodithioic acid,diethyl-, 2-benzothiazolyl ester (9CI);2-Benzothiazolethiol,diethyldithiocarbamate (ester) (8CI);2-(N,N-Diethylthiocarbamoylthio)benzothiazole;2-Benzothiazyl-N,N-diethylthiocarbamylsulfide;Diethyldithiocarbamic acid 2-benzothiazolyl ester;Ethylac;N,N-Diethylthiocarbamoyl 2-benzothiazolyl sulfide;NSC 4035;Nocceler 64;
  • PSA 101.76000
  • LogP 4.01510

2-Benzothiazolyl diethyldithiocarbamate Chemical Properties

Molecular Structure of 2-Benzothiazolyl-N,N-diethylthiocarbamyl sulfide (CAS NO.95-30-7):

EINECS: 202-408-6
IUPAC Name: 1,3-Benzothiazol-2-yl N,N-diethylcarbamodithioate 
Molecular Formula: C12H14N2S3
Molecular Weight: 282.447960 g/mol
XLogP3: 4.2
H-Bond Donor: 0
H-Bond Acceptor: 1
Canonical SMILES: CCN(CC)C(=S)SC1=NC2=CC=CC=C2S1
InChI: InChI=1S/C12H14N2S3/c1-3-14(4-2)12(15)17-11-13-9-7-5-6-8-10(9)16-11/h5-8H,3-4H2,1-2H3
InChIKey: LFMQNMXVVXHZCC-UHFFFAOYSA-N
Index of Refraction: 1.693
Molar Refractivity: 82.4 cm3
Molar Volume: 214.8 cm3
Surface Tension: 66.9 dyne/cm
Density: 1.31 g/cm3
Flash Point: 190.4 °C
Enthalpy of Vaporization: 64.09 kJ/mol
Boiling Point: 391.3 °C at 760 mmHg
Vapour Pressure: 2.49E-06 mmHg at 25 °C
Melting Point: 79 °C
Water Solubility: 47.72 mg/L at 25 °C
BRN: 0220149

2-Benzothiazolyl diethyldithiocarbamate Toxicity Data With Reference

1.    

orl-rat LD50:6 g/kg

     IPSTB3    International Polymer Science and Technology. 3 (1976),93.
2.    

orl-rbt LD50:2700 mg/kg

     RCTEA4    Rubber Chemistry and Technology. 44 (1971),512.

2-Benzothiazolyl diethyldithiocarbamate Consensus Reports

Reported in EPA TSCA Inventory.

2-Benzothiazolyl diethyldithiocarbamate Safety Profile

Safety Information of 2-Benzothiazolyl-N,N-diethylthiocarbamyl sulfide (CAS NO.95-30-7):
RTECS: EZ4950000
Moderately toxic by ingestion. See also CARBAMATES. When heated to decomposition it emits very toxic fumes of NOx and SOx.

2-Benzothiazolyl diethyldithiocarbamate Specification

  2-Benzothiazolyl-N,N-diethylthiocarbamyl sulfide with CAS registry number of 95-30-7 is also known as 2-((N,N-Diethyldithio)carbamyl)benzoathiazole ; 2-(N,N-Diethyldithiocarbamyl)benzoathinzole ; 2-Benzothiazolethiol, diethyldithiocarbamate (ester) ; 2-Benzothiazolyl diethyldithiocarbamate ; 2-Benzothiazyl N,N-diethylthiocarbamoyl sulfide ; 2-Benzothiazyl-N,N-diethylthiocarbamylsulfide ; 4-27-00-01851 (Beilstein Handbook Reference) ; Diethyldithiocarbamic acid, 2-benzothiazolyl ester ; Ethylac ; N,N-Diethylthiocarbamoyl 2-benzothiazolyl sulfide ; N,N-Diethylthiocarbamyl-2-benzothiazolyl sulphide ; NSC 4035 ; Benzothiazol-2-yl diethyldithiocarbamate ; Carbamic acid, diethyldithio-, 2-benzothiazolyl ester ; Carbamodithioic acid, N,N-diethyl-, 2-benzothiazolyl ester ; Carbamodithioic acid, diethyl-, 2-benzothiazolyl ester .

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