Cas no 51719-67-6 (2-(3,4,5-trimethylphenyl)acetic acid)

2-(3,4,5-trimethylphenyl)acetic acid structure
51719-67-6 structure
Product Name:2-(3,4,5-trimethylphenyl)acetic acid
CAS No:51719-67-6
MF:C11H14O2
MW:178.227663516998
MDL:MFCD17019474
CID:935731
PubChem ID:261484
Update Time:2025-04-19

2-(3,4,5-trimethylphenyl)acetic acid Chemical and Physical Properties

Names and Identifiers

    • (3,4,5-TRIMETHYL-PHENYL)-ACETIC ACID
    • 2-(3,4,5-trimethylphenyl)acetic acid
    • (3,4,5-trimethylphenyl)acetic acid
    • AC1L65EV
    • AC1Q5VHM
    • AR-1A3819
    • CTK4J4732
    • KST-1A5261
    • NCIOpen2_001560
    • NSC93686
    • SureCN1258850
    • 3,4,5-Trimethylbenzeneacetic acid
    •  
    • 3,4,5-trimethylphenylacetic acid
    • DTXSID20294040
    • NSC 93686
    • EN300-260442
    • DS-004635
    • SCHEMBL1258850
    • NSC-93686
    • 51719-67-6
    • MDL: MFCD17019474
    • Inchi: 1S/C11H14O2/c1-7-4-10(6-11(12)13)5-8(2)9(7)3/h4-5H,6H2,1-3H3,(H,12,13)
    • InChI Key: VSSHUPHLEXRDDT-UHFFFAOYSA-N
    • SMILES: OC(CC1C=C(C)C(C)=C(C)C=1)=O

Computed Properties

  • Exact Mass: 178.09942
  • Monoisotopic Mass: 178.099379685g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 177
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.1
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • Density: 1.075
  • PSA: 37.3

2-(3,4,5-trimethylphenyl)acetic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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Aaron
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