Cas no 6158-54-9 (Methyl 4-benzoylbenzoate)

Methyl 4-benzoylbenzoate structure
Methyl 4-benzoylbenzoate structure
Product Name:Methyl 4-benzoylbenzoate
CAS No:6158-54-9
MF:C15H12O3
MW:240.253984451294
MDL:MFCD00197207
CID:516721
PubChem ID:349620
Update Time:2025-04-19

Methyl 4-benzoylbenzoate Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid,4-benzoyl-, methyl ester
    • methyl 4-benzoylbenzoate
    • Benzoic acid, p-benzoyl-, methyl ester
    • Methyl 4-benzophenonecarboxylate
    • Methyl p-benzoyl benzoate
    • Benzoic acid, 4-benzoyl-, methyl ester
    • UPXFXAMIFNGJLD-UHFFFAOYSA-N
    • methyl p-benzoylbenzoate
    • Methyl 4-benzoylbenzoate #
    • 4-Benzoylbenzoic acid methyl
    • Methyl 4-(phenylcarbonyl)benzoate
    • 4-benzoylbenzoic acid methyl ester
    • 4-benzoyl-benzoic acid methyl ester
    • NSC409445
    • DTXSID20325247
    • NSC-409445
    • SCHEMBL695012
    • 6158-54-9
    • Methyl4-benzoylbenzoate
    • 4-BENZOYL METHYL BENZOATE
    • AS-63501
    • NS00125753
    • CS-0197325
    • A12692
    • AKOS016053143
    • MFCD00197207
    • Methyl 4-benzoylbenzoate
    • MDL： MFCD00197207
    • Inchi： 1S/C15H12O3/c1-18-15(17)13-9-7-12(8-10-13)14(16)11-5-3-2-4-6-11/h2-10H,1H3
    • InChI Key： UPXFXAMIFNGJLD-UHFFFAOYSA-N
    • SMILES： O=C(C1C=CC=CC=1)C1C=CC(C(=O)OC)=CC=1

Computed Properties

  • Exact Mass: 240.07866
  • Monoisotopic Mass: 240.079
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 4
  • Complexity: 297
  • 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: 3.5
  • Topological Polar Surface Area: 43.4

Experimental Properties

  • Density: 1.169
  • Boiling Point: 380°C at 760 mmHg
  • Flash Point: 168.8°C
  • Refractive Index: 1.574
  • PSA: 43.37
  • LogP: 2.70420

Methyl 4-benzoylbenzoate Pricemore >>

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