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Substance Name: Carbamodithioic acid, N,N-dimethyl-, 2,4-dinitrophenyl ester
RN: 89-37-2
InChIKey: AIWZJEMZVHJAQB-UHFFFAOYSA-N

Molecular Formula

  • C9-H9-N3-O4-S2

Molecular Weight

  • 287.319
 
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Names and Synonyms

Synonyms

  • 2,4-Dinitrophenyl-dimethyl-dithiocarbamate
  • 4-06-00-01760 (Beilstein Handbook Reference)
  • AI3-28653
  • BRN 2475355
  • EINECS 201-902-9
  • NSC 11461
  • USAF SN-31

Systematic Names

  • 2,4-Dinitrophenyl dimethyldithiocarbamate
  • Carbamic acid, dimethyldithio-, 2,4-dinitrophenyl ester
  • Carbamodithioic acid, dimethyl-, 2,4-dinitrophenyl ester
  • Carbamodithioic acid, N,N-dimethyl-, 2,4-dinitrophenyl ester

Registry Numbers

CAS Registry Number

  • 89-37-2

System Generated Number

  • 0000089372

Structure Descriptors

InChI

1S/C9H9N3O4S2/c1-10(2)9(17)18-8-4-3-6(11(13)14)5-7(8)12(15)16/h3-5H,1-2H3

InChIKey

AIWZJEMZVHJAQB-UHFFFAOYSA-N

Smiles

c1(c(SC(N(C)C)=S)ccc(c1)[N+](=O)[O-])[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   National Technical Information Service. Vol. AD277-689,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 152.5 deg C   EXP
log P (octanol-water) 2.140 (none)   EST
Atmospheric OH Rate Constant 6.87E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.