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5-methyl-1-naphthoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM145802

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₁₂H₉O₂

charge

-1

mass

185.0608

reference

InChIKey

VLEZTIKHFUAVRK-UHFFFAOYSA-M

InChI

InChI=1S/C12H10O2/c1-8-4-2-6-10-9(8)5-3-7-11(10)12(13)14/h2-7H,1H3,(H,13,14)/p-1

SMILES

Cc1cccc2c(C(=O)[O-])cccc12

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:78251 chebi:78251	5-methyl-1-naphthoate 5-methylnaphthalene-1-carboxylate
kegg.compound:C20803 keggC:C20803	5-Methyl-1-naphthoate
seed.compound:cpd31362 seedM:cpd31362	5-Methyl-1-naphthoate 5-methyl-1-naphthoate 5-methyl-1-naphthoic acid
metacyc.compound:CPD-16514 metacycM:CPD-16514	5-methyl-1-naphthoate 5-methyl-1-naphthoic acid
CHEBI:79082 chebi:79082	5-methyl-1-naphthoic acid 5-methylnaphthalene-1-carboxylic acid
keggC:M_C20803 seedM:M_cpd31362	secondary/obsolete/fantasy identifier