Home Halogens Pyridine, 3-bromo-5-isocyanato-

Pyridine, 3-bromo-5-isocyanato-

CAS No.:
167951-51-1
Catalog Number:
AG001XPJ
Molecular Formula:
C6H3BrN2O
Molecular Weight:
199.0048
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Product Description
Catalog Number:
AG001XPJ
Chemical Name:
Pyridine, 3-bromo-5-isocyanato-
CAS Number:
167951-51-1
Molecular Formula:
C6H3BrN2O
Molecular Weight:
199.0048
MDL Number:
MFCD09879965
IUPAC Name:
3-bromo-5-isocyanatopyridine
InChI:
InChI=1S/C6H3BrN2O/c7-5-1-6(9-4-10)3-8-2-5/h1-3H
InChI Key:
PNEYUZGELZQGCX-UHFFFAOYSA-N
SMILES:
O=C=Nc1cncc(c1)Br
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.943g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.007g/mol
Monoisotopic Mass:
197.943g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties