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CS-W001157 4
Total: USD 88.00

3-Methyl-3-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)butanoic acid

  • CAS No. 40662-29-1

  • Cat. No. CS-0451974
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

3-Methyl-3-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)butanoic acid|CS-0451974

Structure of 40662-29-1

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General Information

  • CAS No. 40662-29-1
  • Cat. No. CS-0451974
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₈O₄
  • Molecular Weight 250.29
  • Synonym(s) 3-(2,3,5-Trimethyl-1,4-benzoquinonyl)-3-methylbutyric Acid
  • SMILES OC(CC(C)(C1=C(C(C(=C(C1=O)C)C)=O)C)C)=O

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P362+P364

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Computational Chemistry Data

  • TPSA   71.44
  • LogP   2.292
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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