Record Information
Version1.0
Creation Date2009-03-26 19:26:29 UTC
Update Date2026-04-06 07:31:53 UTC
Accession NumberCHEM000627
Identification
Common NameAmmonium dichromate
ClassSmall Molecule
DescriptionAmmonium dichromate is a chemical compound of hexavalent chromium. It has been used in pyrotechnics. Hexavalent chromium refers to chemical compounds that contain the element chromium in the +6 oxidation state. Chromium(VI) is more toxic than other oxidation states of the chromium atom because of its greater ability to enter cells and higher redox potential. (6, 7)
Contaminant Sources
  • Clean Air Act Chemicals
  • ECHA Toxic for reproduction
  • IARC Carcinogens Group 1
  • OECD HPV Chemicals
  • T3DB toxins
Contaminant Type
  • Chromium Compound
  • Industrial/Workplace Toxin
  • Inorganic Compound
  • Pollutant
  • Synthetic Compound
Chemical Structure
Thumb
Synonyms
ValueSource
Diamine dichromium heptahydric acidGenerator
Chemical FormulaCr2H20N2O7
Average Molecular Mass264.159 g/mol
Monoisotopic Mass264.008 g/mol
CAS Registry Number7789-09-5
IUPAC Namediammonium dichromium pentahydrate dihydroxide
Traditional Namediammonium dichromium pentahydrate dihydroxide
SMILES[NH4+].[NH4+].O.O.O.O.O.[OH-].[OH-].[Cr].[Cr]
InChI IdentifierInChI=1S/2Cr.2H3N.7H2O/h;;2*1H3;7*1H2
InChI KeyZBNIJSROPKDLFN-UHFFFAOYSA-N
Chemical Taxonomy
Description belongs to the class of inorganic compounds known as transition metal hydroxides. These are inorganic compounds in which the largest oxoanion is hydroxide, and in which the heaviest atom not in an oxoanion is a transition metal.
KingdomInorganic compounds
Super ClassMixed metal/non-metal compounds
ClassTransition metal oxoanionic compounds
Sub ClassTransition metal hydroxides
Direct ParentTransition metal hydroxides
Alternative Parents
Substituents
  • Transition metal hydroxide
  • Inorganic hydride
  • Inorganic oxide
  • Inorganic salt
Molecular FrameworkNot Available
External DescriptorsNot Available
Biological Properties
StatusDetected and Not Quantified
OriginExogenous
Cellular Locations
  • Membrane
Biofluid LocationsNot Available
Tissue LocationsNot Available
PathwaysNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Physical Properties
StateSolid
AppearanceOrange crystals.
Experimental Properties
PropertyValue
Melting Point180°C
Boiling PointNot Available
SolubilityNot Available
Predicted Properties
PropertyValueSource
Water Solubility156 g/LALOGPS
logP-1.3ALOGPS
logP-0.16ChemAxon
logS0.18ALOGPS
Physiological Charge0ChemAxon
Hydrogen Acceptor Count0ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area0 ŲChemAxon
Rotatable Bond Count0ChemAxon
Refractivity0 m³·mol⁻¹ChemAxon
Polarizability1.78 ųChemAxon
Number of Rings0ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon
Spectra
Spectra
Spectrum TypeDescriptionSplash KeyView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Positivesplash10-014i-0090000000-66bd6f4c87fcef4d37c6Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-014i-0090000000-66bd6f4c87fcef4d37c6Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-014i-0090000000-66bd6f4c87fcef4d37c6Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Negativesplash10-03di-0090000000-a422077feeb719f1ce55Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Negativesplash10-03di-0090000000-a422077feeb719f1ce55Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Negativesplash10-03di-0090000000-a422077feeb719f1ce55Spectrum
Toxicity Profile
Route of ExposureInhalation (6) ; oral (6) ; dermal (6)
Mechanism of ToxicityHexavalent chromium's carcinogenic effects are caused by its metabolites, pentavalent and trivalent chromium. The DNA damage may be caused by hydroxyl radicals produced during reoxidation of pentavalent chromium by hydrogen peroxide molecules present in the cell. Trivalent chromium may also form complexes with peptides, proteins, and DNA, resulting in DNA-protein crosslinks, DNA strand breaks, DNA-DNA interstrand crosslinks, chromium-DNA adducts, chromosomal aberrations and alterations in cellular signaling pathways. It has been shown to induce carcinogenesis by overstimulating cellular regulatory pathways and increasing peroxide levels by activating certain mitogen-activated protein kinases. It can also cause transcriptional repression by cross-linking histone deacetylase 1-DNA methyltransferase 1 complexes to CYP1A1 promoter chromatin, inhibiting histone modification. Chromium may increase its own toxicity by modifying metal regulatory transcription factor 1, causing the inhibition of zinc-induced metallothionein transcription. (1, 6, 2, 3, 4)
MetabolismChromium is absorbed from oral, inhalation, or dermal exposure and distributes to nearly all tissues, with the highest concentrations found in kidney and liver. Bone is also a major storage site and may contribute to long-term retention. Hexavalent chromium's similarity to sulfate and chromate allow it to be transported into cells via sulfate transport mechanisms. Inside the cell, hexavalent chromium is reduced first to pentavalent chromium, then to trivalent chromium by many substances including ascorbate, glutathione, and nicotinamide adenine dinucleotide. Chromium is almost entirely excreted with the urine. (1, 6)
Toxicity ValuesLD50: 22 mg/kg (Oral, Rat) (6) LD50: 30 mg/kg (Intravenous, Rat) (10) LD50: 763 mg/kg (Dermal, Rabbit) (6) L C50: 82 mg/m3 over 4 hours (Inhalation, Rat) (6)
Lethal Dose1 to 3 grams for an adult human (hexavalent chromium). (5)
Carcinogenicity (IARC Classification)1, carcinogenic to humans. (9)
Uses/SourcesAmmonium dichromate is used in pyrotechnics, as a mordant for dyeing pigments, in the manufacturing of alizarin, and chrome alum, in leather tanning and in oil purification. (7)
Minimum Risk LevelIntermediate Inhalation: 0.0002 mg/m3 (8) Chronic Inhalation: 0.00009 mg/m3 (8)
Health EffectsHexavalent chromium is a known carcinogen. Chronic inhalation especially has been linked to lung cancer. Hexavalent chromium has also been know to cause reproductive and developmental defects. (1)
SymptomsBreathing hexavalent chromium can cause irritation to the lining of the nose, nose ulcers, runny nose, and breathing problems, such as asthma, cough, shortness of breath, or wheezing. Ingestion of hexavalent chromium causes irritation and ulcers in the stomach and small intestine, as well as anemia. Skin contact can cause skin ulcers. (6)
TreatmentThere is no know antidote for chromium poisoning. Exposure is usually handled with symptomatic treatment. (6)
Concentrations
Not Available
DrugBank IDNot Available
HMDB IDNot Available
FooDB IDNot Available
Phenol Explorer IDNot Available
KNApSAcK IDNot Available
BiGG IDNot Available
BioCyc IDNot Available
METLIN IDNot Available
PDB IDNot Available
Wikipedia LinkNot Available
Chemspider IDNot Available
ChEBI IDNot Available
PubChem Compound ID131664210
Kegg Compound IDNot Available
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available