Record Information
Version1.0
Creation date2010-04-08 22:09:31 UTC
Update date2018-05-28 23:29:47 UTC
Primary IDFDB011218
Secondary Accession NumbersNot Available
Chemical Information
FooDB NameRoxarsone
DescriptionIt is used to control enteric infections in chicken and to improve growth and feed efficiency. FDA approved additive for chicken, turkey and swine feeds.
CAS Number121-19-7
Structure
Thumb
Synonyms
SynonymSource
(4-Hydroxy-3-nitrobenzene)arsonic aciddb_source
(4-Hydroxy-3-nitrophenyl)-arsonic acidHMDB
2-Nitro-1-hydroxybenzene-4-arsonateGenerator
2-Nitro-1-hydroxybenzene-4-arsonic acidbiospider
2-Nitrophenol-4-arsonic acidbiospider
3-Nitrobiospider
3-Nitro-10biospider
3-Nitro-20biospider
3-Nitro-4-hydroxybenzenearsonateGenerator
3-Nitro-4-hydroxybenzenearsonic acidbiospider
3-Nitro-4-hydroxyphenylarsonateGenerator
3-Nitro-4-hydroxyphenylarsonic acidbiospider
3-Nitro-50biospider
3-Nitro-80biospider
3N4hpabiospider
4-HYDROXY-3-NITRO-BENZENEARSONIC ACIDbiospider
4-Hydroxy-3-nitrobenzenearsonateGenerator
4-Hydroxy-3-nitrobenzenearsonic acidbiospider
4-hydroxy-3-nitrophenyl arsonic acidbiospider
4-Hydroxy-3-nitrophenylarsonateGenerator
4-Hydroxy-3-nitrophenylarsonic acidbiospider
Aklomix-3biospider
Arsonic acid, (4-hydroxy-3-nitrophenyl)-biospider
Arsonic acid, As-(4-hydroxy-3-nitrophenyl)-biospider
As-(4-hydroxy-3-nitrophenyl)-arsonic acidHMDB
Benzenearsonic acid, 4-hydroxy-3-nitro-biospider
C6H6AsNO6biospider
Nitro acid 100 per centbiospider
Nitrophenolarsonic acidbiospider
Nitrophenoloarsonic acidbiospider
NSC 2101db_source
NSC-2101ChEBI
Ren o-salbiospider
Ren-O-saldb_source
Ristatdb_source
Roxarsonbiospider
Roxarsonebiospider
Roxarsone (usp/inn)biospider
Roxarsone [usan:inn:ban]biospider
Roxarsone, BAN, INN, USANdb_source
Roxarsone(usan)biospider
Roxarsonumbiospider
Predicted PropertiesNot Available
Chemical FormulaC6H6AsNO6
IUPAC name
InChI IdentifierInChI=1S/C6H6AsNO6/c9-6-2-1-4(7(10,11)12)3-5(6)8(13)14/h1-3,9H,(H2,10,11,12)
InChI KeyXMVJITFPVVRMHC-UHFFFAOYSA-N
Isomeric SMILESOC1=C(C=C(C=C1)[As](O)(O)=O)N(=O)=O
Average Molecular Weight263.0365
Monoisotopic Molecular Weight262.941108346
Classification
ClassificationNot classified
Ontology
Physiological effect

Health effect:

Disposition

Route of exposure:

Source:

Biological location:

Role

Industrial application:

Biological role:

Physico-Chemical Properties - Experimental
Physico-Chemical Properties - Experimental
PropertyValueReference
Physical stateNot Available
Physical DescriptionNot Available
Mass CompositionC 27.40%; H 2.30%; As 28.48%; N 5.32%; O 36.50%DFC
Melting PointMp 300°DFC
Boiling PointNot Available
Experimental Water SolubilityNot Available
Experimental logPNot Available
Experimental pKaNot Available
Isoelectric pointNot Available
ChargeNot Available
Optical RotationNot Available
Spectroscopic UV DataNot Available
DensityNot Available
Refractive IndexNot Available
Spectra
Spectra
EI-MS/GC-MSNot Available
MS/MSNot Available
NMRNot Available
ChemSpider ID4925
ChEMBL IDCHEMBL1321154
KEGG Compound IDNot Available
Pubchem Compound ID5104
Pubchem Substance IDNot Available
ChEBI ID35817
Phenol-Explorer IDNot Available
DrugBank IDNot Available
HMDB IDHMDB33205
CRC / DFC (Dictionary of Food Compounds) IDGFP49-M:GFP49-M
EAFUS IDNot Available
Dr. Duke IDNot Available
BIGG IDNot Available
KNApSAcK IDNot Available
HET IDNot Available
Food Biomarker OntologyNot Available
VMH IDNot Available
Flavornet IDNot Available
GoodScent IDNot Available
SuperScent IDNot Available
Wikipedia IDNot Available
Phenol-Explorer Metabolite IDNot Available
Duplicate IDSNot Available
Old DFC IDSNot Available
Associated Foods
FoodContent Range AverageReference
FoodReference
Biological Effects and Interactions
Health Effects / BioactivitiesNot Available
EnzymesNot Available
PathwaysNot Available
MetabolismNot Available
BiosynthesisNot Available
Organoleptic Properties
FlavoursNot Available
Files
MSDSNot Available
References
Synthesis ReferenceNot Available
General ReferenceNot Available
Content Reference