Cas no 2379-78-4 (C.I. Vat Orange 15)

C.I. Vat Orange 15 structure
C.I. Vat Orange 15 structure
Product Name:C.I. Vat Orange 15
CAS No:2379-78-4
MF:C42H23N3O6
MW:665.648530244827
CID:42849
PubChem ID:75416
Update Time:2025-04-18

C.I. Vat Orange 15 Chemical and Physical Properties

Names and Identifiers

    • C.I. Vat Orange 15
    • Vat Orange 15 (C.I.)
    • N,N-(10,15,16,17-tetrahydro-5,10,15,17-tetraoxo-5H-dinaphtho[2,3-a:2,3-i]carbazole)-4,11-di(benzamide)
    • 4,11-bis-benzoylamino-16H-dinaphtho[2,3-a,2',3'-i]carbazole-5,10,15,17-tetraone
    • EINECS 219-167-8
    • Vat Orange 15
    • C.I. 69025
    • N,N'-(10,15,16,17-Tetrahydro-5,10,15,17-tetraoxo-5H-dinaphtho[2,3-a:2',3'-i]carbazole-4,11-diyl)bis(benzamide)
    • Benzamide, N,N'-(10,15,16,17-tetrahydro-5,10,15,17-tetraoxo-5H-dinaphtho(2,3-a:2',3'-i)carbazole-4,11-diyl)bis-
    • NS00020773
    • n,n'-(5,10,15,17-tetraoxo-10,15,16,17-tetrahydro-5h-dinaphtho[2,3-a:2',3'-i]carbazole-4,11-diyl)dibenzamide
    • DTXSID9062358
    • SCHEMBL21110888
    • W-109778
    • N-(24-benzamido-6,13,19,26-tetraoxo-16-azaheptacyclo[15.12.0.02,15.05,14.07,12.018,27.020,25]nonacosa-1(17),2(15),3,5(14),7(12),8,10,18(27),20(25),21,23,28-dodecaen-8-yl)benzamide
    • Benzamide, N,N'-(10,15,16,17-tetrahydro-5,10,15,17-tetraoxo-5H-dinaphtho[2,3-a:2',3'-i]carbazole-4,11-diyl)bis-
    • 2379-78-4
    • N,N'-(10,15,16,17-Tetrahydro-5,10,15,17-tetraoxo-5H-dinaphtho(2,3-a:2',3'-i)carbazole-4,11-diyl)bis(benzamide)
    • C.I.Vat Orange 15
    • 219-167-8
    • DTXCID9036939
    • N,N'-(10,15,16,17-Tetrahydro-5,10,15,17-tetraoxo-5H-dinaphtho[2,3-a:2',3'-i]carbazole-4,11-diyl)bis[benzamide]
    • C.I.Vat Orange 15 (C.I.69025)
    • Inchi: 1S/C42H23N3O6/c46-37-27-19-17-23-24-18-20-28-34(40(49)26-14-8-16-30(32(26)38(28)47)44-42(51)22-11-5-2-6-12-22)36(24)45-35(23)33(27)39(48)25-13-7-15-29(31(25)37)43-41(50)21-9-3-1-4-10-21/h1-20,45H,(H,43,50)(H,44,51)
    • InChI Key: WZSLDJBBPHUGJT-UHFFFAOYSA-N
    • SMILES: O=C1C2C=CC=C(C=2C(C2C=CC3C4C=CC5C(C6C(=CC=CC=6C(C=5C=4NC=3C=21)=O)NC(C1C=CC=CC=1)=O)=O)=O)NC(C1C=CC=CC=1)=O

Computed Properties

  • Exact Mass: 665.15900
  • Monoisotopic Mass: 665.159
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 51
  • Rotatable Bond Count: 4
  • Complexity: 1340
  • 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: 142A^2
  • XLogP3: 8.1

Experimental Properties

  • Density: 1.537
  • Refractive Index: 1.831
  • PSA: 142.27000
  • LogP: 7.52250
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