2-(4-Hydroxy-3,5-dinitrophenyl)-ethyl chloride (CHEBI:216028)

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CHEBI:216028 - 2-(4-Hydroxy-3,5-dinitrophenyl)-ethyl chloride

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ChEBI ID	CHEBI:216028
ChEBI Name	2-(4-Hydroxy-3,5-dinitrophenyl)-ethyl chloride
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C8H7ClN2O5
Net Charge	0
Average Mass	246.606
Monoisotopic Mass	246.00435
SMILES	O=[N+]([O-])c1cc(CCCl)cc([N+](=O)[O-])c1O
InChI	InChI=1S/C8H7ClN2O5/c9-2-1-5-3-6(10(13)14)8(12)7(4-5)11(15)16/h3-4,12H,1-2H2
InChIKey	UVECJZMPFCYIGJ-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Salegentibacterspecies T436 (ncbitaxon:1729720)	-	PubMed (17551208)

ChEBI Ontology

Outgoing Relation(s)
	2-(4-Hydroxy-3,5-dinitrophenyl)-ethyl chloride (CHEBI:216028) is a dinitrophenol (CHEBI:39352)

IUPAC Name
4-(2-chloroethyl)-2,6-dinitrophenol

Manual Xrefs	Databases
17627837	ChemSpider