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Home > Nitro Compounds > 1190313-68-8

1190313-68-8

1190313-68-8 | 1H-Pyrrolo[3,2-b]pyridine, 3,6-dinitro-

CAS No: 1190313-68-8 Catalog No: AG000HKV MDL No:

Product Description

Catalog Number:
AG000HKV
Chemical Name:
1H-Pyrrolo[3,2-b]pyridine, 3,6-dinitro-
CAS Number:
1190313-68-8
Molecular Formula:
C7H4N4O4
Molecular Weight:
208.1311
IUPAC Name:
3,6-dinitro-1H-pyrrolo[3,2-b]pyridine
InChI:
InChI=1S/C7H4N4O4/c12-10(13)4-1-5-7(9-2-4)6(3-8-5)11(14)15/h1-3,8H
InChI Key:
FHSWYAQOZWKGQA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnc2c(c1)[nH]cc2[N+](=O)[O-]

Properties

Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.023g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.133g/mol
Monoisotopic Mass:
208.023g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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