Cas no 2581-36-4 (Benzoic acid,3,3'-methylenebis[6-hydroxy-5-methyl-)

Benzoic acid,3,3'-methylenebis[6-hydroxy-5-methyl- structure
2581-36-4 structure
Product Name:Benzoic acid,3,3'-methylenebis[6-hydroxy-5-methyl-
CAS No:2581-36-4
MF:C17H16O6
MW:316.305345535278
CID:260097
PubChem ID:17413
Update Time:2025-04-19

Benzoic acid,3,3'-methylenebis[6-hydroxy-5-methyl- Chemical and Physical Properties

Names and Identifiers

    • 5-[(3-carboxy-4-hydroxy-5-methylphenyl)methyl]-2-hydroxy-3-methylbenzoic acid
    • 2,3-CRESOTIC ACID, 5,5'-METHYLENEDI-
    • 3,3'-dicarboxy-4,4'-dihydroxy-5,5'-dimethyldiphenylmethane
    • 4.4'-Dioxy-5.5'-dimethyl-diphenylmethan-dicarbonsaeure-(3.3')
    • 5,5'-Methylenedi-2,3-cresotic acid
    • 6,6'-Dihydroxy-5,5'-dimethyl-3,3'-methandiyl-di-benzoesaeure
    • 6,6'-dihydroxy-5,5'-dimethyl-3,3'-methanediyl-di-benzoic acid
    • BRN 3433298
    • Methylen-di-o-kresotinsaeure
    • NSC408488
    • NSC623548
    • o-Cresotic acid, 5,5'-methylenedi-
    • NSC 408488
    • NSC 623548
    • 5,5'-Methylenebis(2-hydroxy-3-methylbenzoic acid)
    • SCHEMBL9755153
    • 2581-36-4
    • 5,5''-methylenebis(2-hydroxy-3-methylbenzoic acid)
    • 2,2'-DIHYDROXY-3,3'-DIMETHYL-5,5'-METHYLENEDIBENZOIC ACID
    • NSC-623548
    • Oprea1_231968
    • BDBM50056920
    • CS-0450432
    • CHEMBL113835
    • 2, 5,5'-methylenedi-
    • NSC-408488
    • S3D8KC88KC
    • Benzoic acid, 3,3'-methylenebis(6-hydroxy-5-methyl-
    • o-Cresotic acid,5'-methylenedi-
    • Benzoic acid,3'-methylenebis[6-hydroxy-5-methyl-
    • MFCD00045821
    • 5,5'-Methylenedi-o-cresotic acid
    • DTXSID90180466
    • 2-10-00-00398 (Beilstein Handbook Reference)
    • 3,3'-Methylenebis(6-hydroxy-5-methylbenzoic acid)
    • UNII-S3D8KC88KC
    • 5,5 inverted exclamation mark -Methylenebis(2-hydroxy-3-methylbenzoic Acid)
    • 5-(3-carboxy-4-hydroxy-5-methylbenzyl)-2-hydroxy-3-methylbenzoic acid
    • AKOS030492889
    • 5-[(3-carboxy-4-hydroxy-5-methyl-phenyl)methyl]-2-hydroxy-3-methyl-benzoic acid
    • WLN: QVR BQ C1 E1R DQ C1 EVQ
    • SY274866
    • Benzoic acid,3,3'-methylenebis[6-hydroxy-5-methyl-
    • Inchi： 1S/C17H16O6/c1-8-3-10(6-12(14(8)18)16(20)21)5-11-4-9(2)15(19)13(7-11)17(22)23/h3-4,6-7,18-19H,5H2,1-2H3,(H,20,21)(H,22,23)
    • InChI Key： UPLNCYRSCVJILM-UHFFFAOYSA-N
    • SMILES： OC1C(C(=O)O)=CC(=CC=1C)CC1C=C(C(=O)O)C(=C(C)C=1)O

Computed Properties

  • Exact Mass: 316.09468
  • Monoisotopic Mass: 316.095
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 4
  • Complexity: 410
  • 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
  • Topological Polar Surface Area: 115A^2
  • XLogP3: 4

Experimental Properties

  • Density: 1.416
  • Boiling Point: 560.4°Cat760mmHg
  • Flash Point: 306.8°C
  • Refractive Index: 1.664
  • PSA: 115.06
  • LogP: 2.70180

Benzoic acid,3,3'-methylenebis[6-hydroxy-5-methyl- Pricemore >>

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