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Home > Indoles and Oxindole > 94143-17-6
94143-17-6 | 5H-Indolo[2,3-b]quinoxaline, 9-iodo-2-nitro-
CAS No: 94143-17-6 Catalog No: AG005TI3 MDL No:
Product Description
Catalog Number:
AG005TI3
Chemical Name:
5H-Indolo[2,3-b]quinoxaline, 9-iodo-2-nitro-
CAS Number:
94143-17-6
Molecular Formula:
C14H7IN4O2
Molecular Weight:
390.1354
IUPAC Name:
9-iodo-2-nitro-6H-indolo[2,3-b]quinoxaline
InChI:
InChI=1S/C14H7IN4O2/c15-7-1-3-10-9(5-7)13-14(17-10)18-11-4-2-8(19(20)21)6-12(11)16-13/h1-6H,(H,17,18)
InChI Key:
VNGURBHWLOONDG-UHFFFAOYSA-N
SMILES:
Ic1ccc2c(c1)c1nc3cc(ccc3[nH]c1n2)[N+](=O)[O-]
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
389.961g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
390.14g/mol
Monoisotopic Mass:
389.961g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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