Cas no 8023-83-4 (2,6-Dimethylterephthalic acid)

2,6-Dimethylterephthalic acid structure
2,6-Dimethylterephthalic acid structure
Product Name:2,6-Dimethylterephthalic acid
CAS No:8023-83-4
MF:C10H10O4
MW:194.184003353119
CID:985286
Update Time:2023-08-02

2,6-Dimethylterephthalic acid Chemical and Physical Properties

Names and Identifiers

    • fema 2262
    • CASTOREUM
    • 2,6-dimethylterephthalic acid
    • 2,6-Dimethyl-terephthalic Acid
    • 1,4-Benzenedicarboxylic acid, 2,6-dimethyl-
    • NSC59898
    • 2,6-Dimethyl-1,4-benzenedicarboxylic acid
    • 2,6-dimethylbenzene-1,4-dicarboxylic acid
    • AB0026791
    • W8535
    • 2,6-Dimethylterephthalic acid
    • Inchi: 1S/C10H10O4/c1-5-3-7(9(11)12)4-6(2)8(5)10(13)14/h3-4H,1-2H3,(H,11,12)(H,13,14)
    • InChI Key: SIQYOFNSIZEILQ-UHFFFAOYSA-N
    • SMILES: OC(C1C(C)=CC(C(=O)O)=CC=1C)=O

Computed Properties

  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 237
  • XLogP3: 1.7
  • Topological Polar Surface Area: 74.6

Experimental Properties

  • Color/Form: The fresh product is creamy, and the dry product is brownish colored block. The tincture is a brownish liquid with a slight odor and burnt aroma
  • FEMA: 2261 | CASTOREUM OIL
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