Cas no 16323-43-6 (1,4-Benzenediacrylic Acid)

1,4-Benzenediacrylic Acid structure
1,4-Benzenediacrylic Acid structure
Product Name:1,4-Benzenediacrylic Acid
CAS No:16323-43-6
MF:C12H10O4
MW:218.205403804779
MDL:MFCD00002698
CID:87676
Update Time:2025-04-18

1,4-Benzenediacrylic Acid Chemical and Physical Properties

Names and Identifiers

    • 1,4-Benzenediacrylic acid
    • 1,4-Phenylenediacrylic acid
    • TEREPHTHALDICINNAMIC ACID
    • p-phenylenediacrylic acid
    • NSC 133919
    • p-Phenylenebis[acrylic acid]
    • 2-Propenoic acid, 3,3'-(1,4-phenylene)bis-
    • 3,3'-(p-Phenylene)diacrylic acid
    • p-phenylendiacrylic acid
    • DSSTox_CID_5879
    • DSSTox_RID_77957
    • DSSTox_GSID_25879
    • CBDivE_002295
    • Tox21_202476
    • 2-Propenoic acid,3,3'-(1,4-phenylene)bis-
    • 3-[4-(3-hydroxy-3-oxoprop-1-enyl)phenyl]prop-2-enoic acid
    • 1,4-Benzenediacrylic Acid
    • MDL: MFCD00002698
    • Inchi: 1S/C12H10O4/c13-11(14)7-5-9-1-2-10(4-3-9)6-8-12(15)16/h1-8H,(H,13,14)(H,15,16)/b7-5+,8-6+
    • InChI Key: AAFXQFIGKBLKMC-KQQUZDAGSA-N
    • SMILES: OC(/C=C/C1C=CC(/C=C/C(=O)O)=CC=1)=O
    • BRN: 2579464

Computed Properties

  • Exact Mass: 218.05800
  • Monoisotopic Mass: 218.058
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 277
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 2
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • XLogP3: 1.8
  • Topological Polar Surface Area: 74.6

Experimental Properties

  • Color/Form: Not determined
  • Density: 1.358
  • Melting Point: 300°C(dec.)(lit.)
  • Boiling Point: 318.88°C (rough estimate)
  • Flash Point: 245.9 °C
  • Refractive Index: 1.7160 (estimate)
  • PSA: 74.60000
  • LogP: 1.88220
  • Solubility: Not determined

1,4-Benzenediacrylic Acid Security Information

1,4-Benzenediacrylic Acid Pricemore >>

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1,4-Benzenediacrylic Acid Production Method

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