Cas no 22314-94-9 (1,3-dimethyl-9H-Pyrido[3,4-b]indole)

1,3-dimethyl-9H-Pyrido[3,4-b]indole structure
22314-94-9 structure
Product Name:1,3-dimethyl-9H-Pyrido[3,4-b]indole
CAS No:22314-94-9
MF:C13H12N2
MW:196.247782707214
CID:259063
PubChem ID:5342313
Update Time:2025-04-19

1,3-dimethyl-9H-Pyrido[3,4-b]indole Chemical and Physical Properties

Names and Identifiers

    • 1,3-dimethyl-9H-Pyrido[3,4-b]indole
    • 9H-Pyrido(3,4-b)indole, 1,3-dimethyl-
    • 9H-Pyrido[3,4-b]indole,1,3-dimethyl-
    • Cambridge id 5543755
    • HMS1583L09
    • Oprea1_326311
    • SCHEMBL10169901
    • 3-Methylharman
    • 22314-94-9
    • CHEMBL1618326
    • AKOS016008078
    • Oprea1_626031
    • DTXSID20176857
    • Inchi: 1S/C13H12N2/c1-8-7-11-10-5-3-4-6-12(10)15-13(11)9(2)14-8/h3-7,15H,1-2H3
    • InChI Key: TWAREIZVWJSHJJ-UHFFFAOYSA-N
    • SMILES: N1C2C=CC=CC=2C2C=C(C)N=C(C)C1=2

Computed Properties

  • Exact Mass: 196.10016
  • Monoisotopic Mass: 196.100048
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 0
  • Complexity: 241
  • 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
  • Topological Polar Surface Area: 28.7
  • XLogP3: 3.1

Experimental Properties

  • Density: 1.213
  • Boiling Point: 385.9°Cat760mmHg
  • Flash Point: 172.4°C
  • Refractive Index: 1.723
  • PSA: 28.68

1,3-dimethyl-9H-Pyrido[3,4-b]indole Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
A029188956-1g
1,3-Dimethyl-9H-pyrido[3,4-b]indole
22314-94-9 95%
1g
$332.00 2023-09-02
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