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CHEBI:85867 - p-nitrophenyl butyrate

Default Structure
ChEBI IDCHEBI:85867
ChEBI Namep-nitrophenyl butyrate
Stars
ASCII Namep-nitrophenyl butyrate
DefinitionA butyrate ester resulting from the formal condensation of the hydroxy group of 4-nitrophenol with the carboxy group of butyric acid.
Last Modified12 June 2015
SubmitterBijay
DownloadsMolfile
FormulaC10H11NO4
Net Charge0
Average Mass209.201
Monoisotopic Mass209.06881
SMILESCCCC(=O)Oc1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C10H11NO4/c1-2-3-10(12)15-9-6-4-8(5-7-9)11(13)14/h4-7H,2-3H2,1H3
InChIKeyDVDUMIQZEUTAGK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
p-nitrophenyl butyrate (CHEBI:85867) has functional parent 4-nitrophenol (CHEBI:16836)
p-nitrophenyl butyrate (CHEBI:85867) is a C-nitro compound (CHEBI:35716)
p-nitrophenyl butyrate (CHEBI:85867) is a butyrate ester (CHEBI:50477)
IUPAC Name 
4-nitrophenyl butyrate
Synonyms  Source
4-nitrophenyl butanoateChEBI
para-nitrophenyl butyrateChemIDplus
p-nitrophenol butyrateChemIDplus
p-nitrophenyl butanoateChEBI
PNPBSUBMITTER
pNP-butyrateChEBI
Manual XrefsDatabases
CPD0-2413MetaCyc
Registry NumbersSources
Reaxys:1879729Reaxys
CAS:2635-84-9NIST Chemistry WebBook
CAS:2635-84-9ChemIDplus
Citations