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Home > Nitro Compounds > 832080-70-3
832080-70-3 | Quinoxaline, 6-nitro-2,3-bis(2-thiazolyl)-
CAS No: 832080-70-3 Catalog No: AG004VF4 MDL No:
Product Description
Catalog Number:
AG004VF4
Chemical Name:
Quinoxaline, 6-nitro-2,3-bis(2-thiazolyl)-
CAS Number:
832080-70-3
Molecular Formula:
C14H7N5O2S2
Molecular Weight:
341.3677
IUPAC Name:
2-[6-nitro-3-(1,3-thiazol-2-yl)quinoxalin-2-yl]-1,3-thiazole
InChI:
InChI=1S/C14H7N5O2S2/c20-19(21)8-1-2-9-10(7-8)18-12(14-16-4-6-23-14)11(17-9)13-15-3-5-22-13/h1-7H
InChI Key:
ZCPPQZYIPHTCFV-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)nc(c(n2)c1nccs1)c1nccs1
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.004g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.363g/mol
Monoisotopic Mass:
341.004g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
154A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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