Cas no 849021-24-5 (2-(3-Methylphenyl)malondialdehyde)

2-(3-Methylphenyl)malondialdehyde structure
849021-24-5 structure
Product Name:2-(3-Methylphenyl)malondialdehyde
CAS No:849021-24-5
MF:C10H10O2
MW:162.185203075409
MDL:MFCD03426050
CID:716609
PubChem ID:3856855
Update Time:2025-04-19

2-(3-Methylphenyl)malondialdehyde Chemical and Physical Properties

Names and Identifiers

    • Propanedial,2-(3-methylphenyl)-
    • 2-(3-Methylphenyl)malondialdehyde
    • ZIB02124
    • MFCD03426050
    • 2-(3-methylphenyl)propanedial
    • 2-(m-Tolyl)malonaldehyde
    • AKOS006344203
    • SB85355
    • EN300-103767
    • SCHEMBL2558034
    • FS-4938
    • 2-m-tolylmalonaldehyde
    • DTXSID70397414
    • 849021-24-5
    • MDL： MFCD03426050
    • Inchi： 1S/C10H10O2/c1-8-3-2-4-9(5-8)10(6-11)7-12/h2-7,10H,1H3
    • InChI Key： XELVNYQHLUBJGP-UHFFFAOYSA-N
    • SMILES： O=CC(C=O)C1C=CC=C(C)C=1

Computed Properties

  • Exact Mass: 162.068
  • Monoisotopic Mass: 162.068
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 157
  • 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: 1.4
  • Topological Polar Surface Area: 34.1?2

Experimental Properties

  • Color/Form: Not available
  • Density: 1.078
  • Melting Point: 81-83°C
  • Boiling Point: 247.9°C at 760 mmHg
  • Flash Point: 91°C
  • Refractive Index: 1.518
  • PSA: 34.14000
  • LogP: 1.47640
  • Vapor Pressure: Not available

2-(3-Methylphenyl)malondialdehyde Security Information

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