CHEBI:46149 - picric acid

ChEBI IDCHEBI:46149
ChEBI Namepicric acid
Stars
DefinitionA C-nitro compound comprising phenol having three nitro substtituents at the 2-, 4- and 6-positions.
Secondary ChEBI IDsCHEBI:32972, CHEBI:46148
Last Modified21 December 2017
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC6H3N3O7
Net Charge0
Average Mass229.104
Monoisotopic Mass228.99710
SMILESO=[N+]([O-])c1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1
InChIInChI=1S/C6H3N3O7/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-2,10H
InChIKeyOXNIZHLAWKMVMX-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
explosive  A substance capable of undergoing rapid and highly exothermic decomposition.
Biological Role:
fixative  Any compound used for the purpose of preserving biological tissues from decay in such a way as to allow for the preparation of thin, stained sections for subsequent histological study.
Application:
antiseptic drug  A substance used locally on humans and other animals to destroy harmful microorganisms or to inhibit their activity (cf. disinfectants, which destroy microorganisms found on non-living objects, and antibiotics, which can be transported through the lymphatic system to destroy bacteria within the body).
ChEBI Ontology
Outgoing Relation(s)
picric acid (CHEBI:46149) has functional parent 1,3,5-trinitrobenzene (CHEBI:48113)
picric acid (CHEBI:46149) has functional parent phenol (CHEBI:15882)
picric acid (CHEBI:46149) has role antiseptic drug (CHEBI:48218)
picric acid (CHEBI:46149) has role explosive (CHEBI:63490)
picric acid (CHEBI:46149) has role fixative (CHEBI:50913)
picric acid (CHEBI:46149) is a C-nitro compound (CHEBI:35716)
picric acid (CHEBI:46149) is conjugate acid of picrate anion (CHEBI:86297)
Incoming Relation(s)
TNP-ATP (CHEBI:50104) has functional parent picric acid (CHEBI:46149)
picrate anion (CHEBI:86297) is conjugate base of picric acid (CHEBI:46149)
IUPAC Name 
2,4,6-trinitrophenol
Synonyms  Source
PikrinsäureChemIDplus
PICRIC ACIDPDBeChem
acide picriqueChemIDplus
2-hydroxy-1,3,5-trinitrobenzeneNIST Chemistry WebBook
C.I. 10305ChemIDplus
CI 10305ChemIDplus
Manual XrefsDatabases
TNFPDBeChem
Picric_acidWikipedia
DB03651DrugBank
CPD-17566MetaCyc
4626DrugCentral
Registry NumbersSources
Beilstein:423400Beilstein
Gmelin:5312Gmelin
Reaxys:423400Reaxys
CAS:88-89-1ChemIDplus
CAS:88-89-1NIST Chemistry WebBook
Citations