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1190311-16-0

1190311-16-0 | 1H-Pyrrolo[3,2-b]pyridine, 5-bromo-3-nitro-

CAS No: 1190311-16-0 Catalog No: AG000HHR MDL No:

Product Description

Catalog Number:
AG000HHR
Chemical Name:
1H-Pyrrolo[3,2-b]pyridine, 5-bromo-3-nitro-
CAS Number:
1190311-16-0
Molecular Formula:
C7H4BrN3O2
Molecular Weight:
242.0296
IUPAC Name:
5-bromo-3-nitro-1H-pyrrolo[3,2-b]pyridine
InChI:
InChI=1S/C7H4BrN3O2/c8-6-2-1-4-7(10-6)5(3-9-4)11(12)13/h1-3,9H
InChI Key:
OCIVXCNQVWQXFR-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(n1)c(c[nH]2)[N+](=O)[O-]

Properties

Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.949g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
242.032g/mol
Monoisotopic Mass:
240.949g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

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