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2,5-dimethyl-2-ethylhexanoic acid

chemical compound
ChemicalSubstance group_of_stereoisomers Q27288305
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2,5-dimethyl-2-ethylhexanoic acid

Summary

2,5-dimethyl-2-ethylhexanoic acid is a group of stereoisomers[1].

Key Facts

  • 2,5-dimethyl-2-ethylhexanoic acid's instance of is recorded as group of stereoisomers[2].
  • 2,5-dimethyl-2-ethylhexanoic acid's CAS Registry Number is recorded as 24353-79-5[3].
  • 2,5-dimethyl-2-ethylhexanoic acid's canonical SMILES is recorded as CCC(C)(CCC(C)C)C(=O)O[4].
  • 2,5-dimethyl-2-ethylhexanoic acid's InChI is recorded as InChI=1S/C10H20O2/c1-5-10(4,9(11)12)7-6-8(2)3/h8H,5-7H2,1-4H3,(H,11,12)[5].
  • 2,5-dimethyl-2-ethylhexanoic acid's InChIKey is recorded as PKJSRUTWBDIWAR-UHFFFAOYSA-N[6].
  • 2,5-dimethyl-2-ethylhexanoic acid's chemical formula is recorded as C₁₀H₂₀O₂[7].
  • 2,5-dimethyl-2-ethylhexanoic acid's subclass of is recorded as 2,5,5-trimethylheptane monoterpenoid[8].
  • 2,5-dimethyl-2-ethylhexanoic acid's ChEMBL ID is recorded as CHEMBL3188877[9].
  • 2,5-dimethyl-2-ethylhexanoic acid's UNII is recorded as RVD8OZJ00D[10].
  • 2,5-dimethyl-2-ethylhexanoic acid's ChemSpider ID is recorded as 56551[11].
  • 2,5-dimethyl-2-ethylhexanoic acid's PubChem CID is recorded as 62817[12].
  • 2,5-dimethyl-2-ethylhexanoic acid's Human Metabolome Database ID is recorded as HMDB0303133[13].
  • 2,5-dimethyl-2-ethylhexanoic acid's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+172.146'}[14].
  • 2,5-dimethyl-2-ethylhexanoic acid's SureChEMBL ID is recorded as 37688[15].
  • 2,5-dimethyl-2-ethylhexanoic acid's DSSTox substance ID is recorded as DTXSID1058341[16].
  • 2,5-dimethyl-2-ethylhexanoic acid's DSSTOX compound identifier is recorded as DTXCID207916[17].
  • 2,5-dimethyl-2-ethylhexanoic acid's UniChem compound ID is recorded as 26191187[18].

References

Programmatic citations — every numbered marker resolves to a verifiable graph row below.

Direct Wikidata claims

  1. [2] ↑ . wikidata.org.
  2. [3] ↑ . Global Substance Registration System. Retrieved . wikidata.org.
  3. [4] ↑ . PubChem. Retrieved . wikidata.org.
  4. [5] ↑ . PubChem. Retrieved . wikidata.org.
  5. [6] ↑ . PubChem. Retrieved . wikidata.org.
  6. [7] ↑ . PubChem. Retrieved . wikidata.org.
  7. [8] ↑ . wikidata.org.
  8. [9] ↑ . ChEMBL. Retrieved . wikidata.org.
  9. [10] ↑ . Global Substance Registration System. Retrieved . wikidata.org.
  10. [11] ↑ . Q2311683. Retrieved . wikidata.org.
  11. [12] ↑ . PubChem. Retrieved . wikidata.org.
  12. [13] ↑ . wikidata.org.
  13. [14] ↑ . PubChem. Retrieved . wikidata.org.
  14. [15] ↑ . wikidata.org.
  15. [16] ↑ . Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard. wikidata.org.
  16. [17] ↑ . wikidata.org.
  17. [18] ↑ . UniChem. wikidata.org.

Class ancestry

  1. [1] ↑ . Wikidata. wikidata.org.

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