Cas no 158792-23-5 (Benzoic acid,2-hydroxy-4-[(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy]-3,5,6-trimethyl-,4-carboxy-3-methoxy-2,5,6-trimethylphenyl ester)

Benzoic acid,2-hydroxy-4-[(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy]-3,5,6-trimethyl-,4-carboxy-3-methoxy-2,5,6-trimethylphenyl ester structure
158792-23-5 structure
Product Name:Benzoic acid,2-hydroxy-4-[(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy]-3,5,6-trimethyl-,4-carboxy-3-methoxy-2,5,6-trimethylphenyl ester
CAS No:158792-23-5
MF:C32H36O10
MW:580.622250556946
CID:169469
PubChem ID:157810
Update Time:2025-04-19

Benzoic acid,2-hydroxy-4-[(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy]-3,5,6-trimethyl-,4-carboxy-3-methoxy-2,5,6-trimethylphenyl ester Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid,2-hydroxy-4-[(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy]-3,5,6-trimethyl-,4-carboxy-3-methoxy-2,5,6-trimethylphenyl ester
    • 4-[2-hydroxy-4-(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid
    • Benzoic acid,2-hydroxy-4-[(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy]-3,5,6-trimethyl-,4-...
    • Benzoic acid,2-hydroxy-4-[(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy]-3,5,6-trimethyl-,4-carboxy-3-methoxy-2,5,6-trimeth
    • PS 990
    • PS-990
    • 4-((4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy)-2-hydroxy-3,5,6-trimethylbenzoic acid 4-carboxy-3-methoxy-2,5,6-trimethylphenyl ester
    • Benzoic acid, 2-hydroxy-4-((4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy)-3,5,6-trimethyl-, 4-carboxy-3-methoxy-2,5,6-trimethylphenyl ester
    • CHEBI:216036
    • DTXSID10935995
    • 4-({2-Hydroxy-4-[(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy]-3,5,6-trimethylbenzoyl}oxy)-2-methoxy-3,5,6-trimethylbenzoic acid
    • 158792-23-5
    • Inchi： 1S/C32H36O10/c1-12-15(4)24(33)18(7)28(39-10)23(12)32(38)41-26-16(5)13(2)21(25(34)19(26)8)31(37)42-27-17(6)14(3)22(30(35)36)29(40-11)20(27)9/h33-34H,1-11H3,(H,35,36)
    • InChI Key： UESGSZFVMHDIFM-UHFFFAOYSA-N
    • SMILES： O(C(C1C(=C(C)C(=C(C)C=1C)O)OC)=O)C1=C(C)C(=C(C(=O)OC2C(C)=C(C(C(=O)O)=C(C)C=2C)OC)C(C)=C1C)O

Computed Properties

  • Exact Mass: 580.23100
  • Monoisotopic Mass: 580.230847
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 10
  • Heavy Atom Count: 42
  • Rotatable Bond Count: 9
  • Complexity: 971
  • 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: 149
  • XLogP3: 7.3

Experimental Properties

  • Density: 1.261
  • Boiling Point: 825.9°Cat760mmHg
  • Flash Point: 265°C
  • Refractive Index: 1.598
  • PSA: 148.82000
  • LogP: 6.02720

Benzoic acid,2-hydroxy-4-[(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy]-3,5,6-trimethyl-,4-carboxy-3-methoxy-2,5,6-trimethylphenyl ester Related Literature

Related Categories

158792-23-5 (Benzoic acid,2-hydroxy-4-[(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy]-3,5,6-trimethyl-,4-carboxy-3-methoxy-2,5,6-trimethylphenyl ester) Related Products

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