Cas no 138877-60-8 (3H-Purin-6-amine, 3-[(12-methylbenz[a]anthracen-7-yl)methyl]-)

3H-Purin-6-amine, 3-[(12-methylbenz[a]anthracen-7-yl)methyl]- structure
138877-60-8 structure
Product Name:3H-Purin-6-amine, 3-[(12-methylbenz[a]anthracen-7-yl)methyl]-
CAS No:138877-60-8
MF:C25H19N5
MW:389.451864480972
CID:1266228
Update Time:2024-08-04

3H-Purin-6-amine, 3-[(12-methylbenz[a]anthracen-7-yl)methyl]- Chemical and Physical Properties

Names and Identifiers

    • 3H-Purin-6-amine, 3-[(12-methylbenz[a]anthracen-7-yl)methyl]-
    • Inchi: 1S/C25H19N5/c1-15-17-7-4-5-9-19(17)21(12-30-14-29-24(26)23-25(30)28-13-27-23)20-11-10-16-6-2-3-8-18(16)22(15)20/h2-11,13-14H,12,26H2,1H3
    • InChI Key: FTZUYEMAKARNCN-UHFFFAOYSA-N
    • SMILES: N1C2C(N(CC3C4C(C(C)=C5C6=CC=CC=C6C=CC=35)=CC=CC=4)C=NC=2N)=NC=1

Computed Properties

  • Exact Mass: 389.16427

Experimental Properties

  • Density: 1.36±0.1 g/cm3(Predicted)
  • Boiling Point: 636.7±65.0 °C(Predicted)
  • PSA: 66.34
  • pka: 5.62±0.20(Predicted)
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