Cas no 51-82-1 (Carbamodithioic acid,N,N-dimethyl-, (dimethylamino)methyl ester)

Carbamodithioic acid,N,N-dimethyl-, (dimethylamino)methyl ester structure
51-82-1 structure
Product Name:Carbamodithioic acid,N,N-dimethyl-, (dimethylamino)methyl ester
CAS No:51-82-1
MF:C6H14N2S2
MW:178.318758487701
CID:368432
PubChem ID:5830
Update Time:2025-04-19

Carbamodithioic acid,N,N-dimethyl-, (dimethylamino)methyl ester Chemical and Physical Properties

Names and Identifiers

    • Carbamodithioic acid,N,N-dimethyl-, (dimethylamino)methyl ester
    • (dimethylamino)methyl N,N-dimethylcarbamodithioate
    • dimethylaminomethyl dimethyldithiocarbamate
    • BRN 1757112
    • Carbamic acid, dimethyldithio-, (dimethylamino)methyl ester
    • DIMETHYLAMINOMETHYL N,N-DIMETHYLDITHIOCARBAMATE
    • dimethyl-dithiocarbamic acid dimethylaminomethyl ester
    • Dimethyl-dithiocarbamidsaeure-dimethylaminomethylester
    • EINECS 200-126-8
    • HSDB 5193
    • N,N-Dimethyldithiocarbamic acid dimethylaminomethyl ester
    • N,N-Dimethyl-dithiocarbaminsaeure-di-methylaminomethylester
    • NSC 25049
    • Carbamic acid, (dimethylamino)methyl ester
    • NSC-25049
    • WLN: 1N1&YUS&S1N1&1
    • Carbamic acid, N,N-dimethyl-, (dimethylamino)methyl ester
    • N,N-(Dimethyldithio)carbamic acid (dimethylamino)methyl ester
    • DTXSID6058762
    • Carbamic acid, dithio-, N,N-dimethyl-, dimethylaminomethyl ester
    • N,N-Dimethyl-dithiocarbaminsaeure-dimethylaminomethyl-ester [German]
    • N,N-Dimethyl-dithiocarbaminsaeure-dimethylaminomethyl-ester
    • NS00032352
    • Carbamodithioic acid, N,N-dimethyl-, (dimethylamino)methyl ester
    • Carbamodithioic acid, dimethyl-, (dimethylamino)methyl ester
    • NSC25049
    • 51-82-1
    • Carbamodithioic acid, (dimethylamino)methyl ester
    • Inchi: 1S/C6H14N2S2/c1-7(2)5-10-6(9)8(3)4/h5H2,1-4H3
    • InChI Key: WGPLCRLRYUGWKC-UHFFFAOYSA-N
    • SMILES: S(C(N(C)C)=S)CN(C)C

Computed Properties

  • Exact Mass: 178.06002
  • Monoisotopic Mass: 178.05984
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 3
  • Complexity: 112
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.4
  • Topological Polar Surface Area: 63.9

Experimental Properties

  • Density: 1.091 (estimate)
  • Boiling Point: 208.9°Cat760mmHg
  • Flash Point: 80.1°C
  • Refractive Index: 1.5500 (estimate)
  • PSA: 6.48
  • LogP: 1.08520
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