CHEBI:145052 - 1,4-cyclohexanedicarboxylic acid

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ChEBI Name 1,4-cyclohexanedicarboxylic acid ChEBI ID CHEBI:145052 Definition A dicarboxylic acid that is cyclohexane substituted by carboxy groups at positions 1 and 4. Stars This entity has been manually annotated by the ChEBI Team. Submitter Mark Williams Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C8H12O4 Net Charge 0 Average Mass 172.180 Monoisotopic Mass 172.07356 InChI InChI=1S/C8H12O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12) InChIKey PXGZQGDTEZPERC-UHFFFAOYSA-N SMILES OC(=O)C1CCC(CC1)C(O)=O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 1,4-cyclohexanedicarboxylic acid (CHEBI:145052) is a dicarboxylic acid (CHEBI:35692) IUPAC Name cyclohexane-1,4-dicarboxylic acid Synonym Source hexahydroterephthalic acid ChemIDplus Registry Numbers Types Sources 1076-97-7 CAS Registry Number NIST Chemistry WebBook 1076-97-7 CAS Registry Number ChemIDplus Citations Types Sources 16471975 PubMed citation Europe PMC 24821219 PubMed citation Europe PMC 29673054 PubMed citation Europe PMC 30044524 PubMed citation Europe PMC Last Modified 15 October 2019