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1805571-88-3

1805571-88-3 | 3-Pyridinol, 6-bromo-5-nitro-

CAS No: 1805571-88-3 Catalog No: AG00223I MDL No:

Product Description

Catalog Number:
AG00223I
Chemical Name:
3-Pyridinol, 6-bromo-5-nitro-
CAS Number:
1805571-88-3
Molecular Formula:
C5H3BrN2O3
Molecular Weight:
218.9929
IUPAC Name:
6-bromo-5-nitropyridin-3-ol
InChI:
InChI=1S/C5H3BrN2O3/c6-5-4(8(10)11)1-3(9)2-7-5/h1-2,9H
InChI Key:
JCVMCKGUJKQSQT-UHFFFAOYSA-N
SMILES:
Oc1cnc(c(c1)[N+](=O)[O-])Br

Properties

Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.933g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.994g/mol
Monoisotopic Mass:
217.933g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

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