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CHEBI:85645 - p-nitrophenyl palmitate

Default Structure
ChEBI IDCHEBI:85645
ChEBI Namep-nitrophenyl palmitate
Stars
ASCII Namep-nitrophenyl palmitate
DefinitionA palmitate ester obtained by condensation of the carboxy group of palmitic acid with the phenolic hydroxy group of p-nitrophenol.
Last Modified8 May 2015
Submittermammari
DownloadsMolfile
FormulaC22H35NO4
Net Charge0
Average Mass377.525
Monoisotopic Mass377.25661
SMILESCCCCCCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C22H35NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22(24)27-21-18-16-20(17-19-21)23(25)26/h16-19H,2-15H2,1H3
InChIKeyLVZSQWIWCANHPF-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
p-nitrophenyl palmitate (CHEBI:85645) has functional parent 4-nitrophenol (CHEBI:16836)
p-nitrophenyl palmitate (CHEBI:85645) is a C-nitro compound (CHEBI:35716)
p-nitrophenyl palmitate (CHEBI:85645) is a hexadecanoate ester (CHEBI:25835)
IUPAC Name 
4-nitrophenyl hexadecanoate
Synonyms  Source
(4-nitrophenyl) hexadecanoatePDBeChem
4-Nitrophenyl palmitateChemIDplus
p-nitrophenyl hexadecanoateChEBI
Hexadecanoic acid 4-nitrophenyl esterSUBMITTER
para-nitrophenyl palmitateSUBMITTER
paranitrophenyl palmitatePDBeChem
Manual XrefsDatabases
PNRPDBeChem
Registry NumbersSources
Reaxys:1891754Reaxys
CAS:1492-30-4ChemIDplus
CAS:1492-30-4NIST Chemistry WebBook
Citations