Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzoic acid, 3,5-diamino-, hydrochloride (1:2)
RN: 618-56-4
InChIKey: IGPLRBRBTUNCRT-UHFFFAOYSA-N

Molecular Formula

  • C7-H8-N2-O2.2Cl-H

Molecular Weight

  • 225.074
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 3,5-Diaminobenzoic acid dihydrochloride
  • AI3-51087
  • EINECS 210-556-8
  • NSC 57806

Systematic Names

  • 3,5-Diaminobenzoic acid dihydrochloride
  • Benzoic acid, 3,5-diamino-, dihydrochloride
  • Benzoic acid, 3,5-diamino-, hydrochloride (1:2)

Registry Numbers

CAS Registry Number

  • 618-56-4

Related Registry Number

  • 535-87-5 (Parent)

System Generated Number

  • 0000618564

Molecular Formulas

Molecular Formula

  • C7-H8-N2-O2.2Cl-H

Molecular Formula Fragments

  • C7-H8-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C7H8N2O2.2ClH/c8-5-1-4(7(10)11)2-6(9)3-5;;/h1-3H,8-9H2,(H,10,11);2*1H

InChIKey

IGPLRBRBTUNCRT-UHFFFAOYSA-N

Smiles

c1(cc(cc(c1)[NH2+])[NH2+])C(O)=O.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 180mg/kg (180mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#00464,