Cas no 5349-76-8 (1,3-Benzenediamine, 4-methoxy-6-methyl-)

1,3-Benzenediamine, 4-methoxy-6-methyl- structure
5349-76-8 structure
Product Name:1,3-Benzenediamine, 4-methoxy-6-methyl-
CAS No:5349-76-8
MF:C8H12N2O
MW:152.193681716919
CID:377563
PubChem ID:220707
Update Time:2025-04-19

1,3-Benzenediamine, 4-methoxy-6-methyl- Chemical and Physical Properties

Names and Identifiers

    • 1,3-Benzenediamine, 4-methoxy-6-methyl-
    • 4-methoxy-6-methylbenzene-1,3-diamine
    • 5-Methyl-2.4-diaminoanisole
    • 1,3-Benzenediamine,4-methoxy-6-methyl
    • 1,4-methoxy-6-methyl
    • 2,4-diamino-1-methoxy-5-methyl-benzene
    • 4-Methoxy-6-methyl-m-phenylendiamin
    • 4-methoxy6-methyl-m-phenylenediamine
    • 5-Methoxy-2,4-diamino-toluol
    • SCHEMBL453847
    • starbld0044598
    • NSC3830
    • DTXSID50277745
    • 1,3-Benzenediamine, 4-methoxy-6-methyl-
    • 1,3-Benzenediamine,4-methoxy-6-methyl-
    • NSC-3830
    • 5349-76-8
    • AKOS006274153
    • 1, 4-methoxy-6-methyl-
    • Inchi: 1S/C8H12N2O/c1-5-3-8(11-2)7(10)4-6(5)9/h3-4H,9-10H2,1-2H3
    • InChI Key: JOJAEBZHFWYZAY-UHFFFAOYSA-N
    • SMILES: O(C)C1=CC(C)=C(C=C1N)N

Computed Properties

  • Exact Mass: 152.09500
  • Monoisotopic Mass: 152.095
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 129
  • 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: 0.9
  • Topological Polar Surface Area: 61.3?2

Experimental Properties

  • Density: 1.133
  • Boiling Point: 316°Cat760mmHg
  • Flash Point: 166.7°C
  • Refractive Index: 1.604
  • PSA: 61.27000
  • LogP: 2.33040
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