Product Name

  • Name

    methyl(phenyl)carbamodithioic acid

  • EINECS
  • CAS No. 42139-51-5
  • Article Data3
  • CAS DataBase
  • Density 1.251g/cm3
  • Solubility
  • Melting Point
  • Formula C8H12N2S2
  • Boiling Point 252.3°C at 760 mmHg
  • Molecular Weight 200.329
  • Flash Point 106.4°C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 42139-51-5 (methyl(phenyl)carbamodithioic acid)
  • Hazard Symbols
  • Synonyms Carbanilicacid, N-methyldithio-, NH4 salt (7CI);
  • PSA
  • LogP

Carbamodithioicacid, methylphenyl-, ammonium salt (9CI) Specification

The Carbamodithioicacid, methylphenyl-, ammonium salt (9CI), with the CAS registry number 42139-51-5, is also known as NSC34223. This chemical's molecular formula is C8H12N2S2 and molecular weight is 200.32428. Its IUPAC name is called azane; methyl(phenyl)carbamodithioic acid.

Physical properties of Carbamodithioicacid, methylphenyl-, ammonium salt (9CI): (1)H-Bond Donor: 1; (2)H-Bond Acceptor: 1; (3)Rotatable Bond Count: 1; (4)Exact Mass: 200.04419; (5)MonoIsotopic Mass: 200.04419; (6)Topological Polar Surface Area: 37.3; (7)Heavy Atom Count: 12; (8)Formal Charge: 0; (9)Complexity: 141; (10)Covalently-Bonded Unit Count: 2.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CN(C1=CC=CC=C1)C(=S)S.N
(2)InChI: InChI=1S/C8H9NS2.H3N/c1-9(8(10)11)7-5-3-2-4-6-7;/h2-6H,1H3,(H,10,11);1H3
(3)InChIKey: UUTDARZAVSEIFY-UHFFFAOYSA-N

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