Cas no 15463-92-0 (Dimethyl 2-phenylbutanedioate)

Dimethyl 2-phenylbutanedioate structure
Dimethyl 2-phenylbutanedioate structure
Product Name:Dimethyl 2-phenylbutanedioate
CAS No:15463-92-0
MF:C12H14O4
MW:222.237164020538
CID:1329382
PubChem ID:582943
Update Time:2025-04-20

Dimethyl 2-phenylbutanedioate Chemical and Physical Properties

Names and Identifiers

    • Butanedioic acid, phenyl-, dimethyl ester
    • 2-(Phenyl)succinic acid dimethyl ester
    • dimethyl 2-phenylbutanedioate
    • ICCB4_000113
    • PHENYLSUCCINIC ACID DIMETHYL ESTER
    • dimethyl2-phenylbutanedioate
    • BCB03_000005
    • Dimethyl 2-phenylsuccinate #
    • Dimethyl 2-phenylsuccinate
    • Succinic acid, phenyl-, dimethyl ester
    • G83780
    • BS-27531
    • SCHEMBL6390962
    • CBiol_000817
    • CBiol_000839
    • ICCB4_000135
    • ICCB6_000213
    • Dimethyl phenylsuccinate
    • 2-phenyl-butanedioic acid dimethyl ester
    • DTXSID60342554
    • 15463-92-0
    • SB49693
    • Dimethyl 2-phenylbutanedioate
    • Inchi： 1S/C12H14O4/c1-15-11(13)8-10(12(14)16-2)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3
    • InChI Key： CGVIBFZHFCVINR-UHFFFAOYSA-N
    • SMILES： O(C)C(C(C1C=CC=CC=1)CC(=O)OC)=O

Computed Properties

  • Exact Mass: 222.08922
  • Monoisotopic Mass: 222.089
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 6
  • Complexity: 243
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 52.6A^2
  • XLogP3: 1.6

Experimental Properties

  • PSA: 52.6

Dimethyl 2-phenylbutanedioate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
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 $115.00 2023-05-18
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