Product Name

  • Name

    [(4-chlorobenzyl)sulfinyl](diethylamino)methanone

  • EINECS
  • CAS No. 51954-76-8
  • Article Data4
  • CAS DataBase
  • Density 1.278g/cm3
  • Solubility
  • Melting Point
  • Formula C12H16ClNO2S
  • Boiling Point 409.8°Cat760mmHg
  • Molecular Weight 273.784
  • Flash Point 201.7°C
  • Transport Information
  • Appearance
  • Safety Mutation data reported. When heated to decomposition it emits toxic vapors of NOx, SOx, and Cl−.
  • Risk Codes
  • Molecular Structure Molecular Structure of 51954-76-8 ([(4-chlorobenzyl)sulfinyl](diethylamino)methanone)
  • Hazard Symbols
  • Synonyms Benthiocarb sulfoxide;Formamide,1-[[(4-chlorophenyl)methyl]- sulfinyl]-N,N-diethyl-;1-(((4-CHLORO-PHENYL)METHYL)SULFINYL)-N,N-DIETHYLFORMAMIDE;THIOBENCARB SULFOXIDE;
  • PSA 56.59000
  • LogP 3.91620

Benthiocarb sulfoxide Chemical Properties

Product Name: Benthiocarb sulfoxide (CAS NO.51954-76-8)


Molecular Formula: C12H16ClNO2S
Molecular Weight: 273.80g/mol
Mol File: 51954-76-8.mol
Boiling point: 409.8 °C at 760 mmHg
Flash Point: 201.7 °C
Density: 1.278 g/cm3
Surface Tension: 54 dyne/cm
Enthalpy of Vaporization: 66.21 kJ/mol
Vapour Pressure: 6.3E-07 mmHg at 25°C
XLogP3-AA: 2.2
H-Bond Donor: 0
H-Bond Acceptor: 2
Structure Descriptors of Benthiocarb sulfoxide (CAS NO.51954-76-8):
  IUPAC Name: 1-[(4-chlorophenyl)methylsulfinyl]-N,N-diethylformamide 
  Canonical SMILES: CCN(CC)C(=O)S(=O)CC1=CC=C(C=C1)Cl
  InChI: InChI=1S/C12H16ClNO2S/c1-3-14(4-2)12(15)17(16)9-10-5-7-11(13)8-6-10/h5-
8H,3-4,9H2,1-2H3 
  InChIKey: VPMMJNZMBQSPCK-UHFFFAOYSA-N

Benthiocarb sulfoxide Toxicity Data With Reference

1.    

mic-sat 300 µLg/plate

     JAFCAU    Journal of Agricultural and Food Chemistry. 45 (1997),990.

Benthiocarb sulfoxide Safety Profile

Mutation data reported. When heated to decomposition it emits toxic vapors of NOx, SOx, and Cl−.

Benthiocarb sulfoxide Specification

 Benthiocarb sulfoxide , its CAS NO. is 51954-76-8, the synonyms are 1-(((4-Chlorophenyl)methyl)sulfinyl)-N,N-diethylformamide ; Thiobencarb sulfoxide ; Formamide, 1-(((4-chlorophenyl)methyl)sulfinyl)-N,N-diethyl- .

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