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13860-55-4 | 6H-Indolo[2,3-b]quinoxaline, 3-nitro-
CAS No: 13860-55-4 Catalog No: AG0018UD MDL No:
Product Description
Catalog Number:
AG0018UD
Chemical Name:
6H-Indolo[2,3-b]quinoxaline, 3-nitro-
CAS Number:
13860-55-4
Molecular Formula:
C14H8N4O2
Molecular Weight:
264.2389
IUPAC Name:
3-nitro-6H-indolo[3,2-b]quinoxaline
InChI:
InChI=1S/C14H8N4O2/c19-18(20)8-5-6-11-12(7-8)17-14-13(15-11)9-3-1-2-4-10(9)16-14/h1-7H,(H,16,17)
InChI Key:
FEIUUTDXVTUBOH-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)nc1c(n2)c2c([nH]1)cccc2
Properties
Complexity:
399
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.065g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.244g/mol
Monoisotopic Mass:
264.065g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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