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Home > Pyridines > 674297-85-9
674297-85-9 | Pyridine, 4-isocyanato-, 1-oxide (9CI)
CAS No: 674297-85-9 Catalog No: AG00FF6Z MDL No:
Product Description
Catalog Number:
AG00FF6Z
Chemical Name:
Pyridine, 4-isocyanato-, 1-oxide (9CI)
CAS Number:
674297-85-9
IUPAC Name:
4-isocyanato-1-oxidopyridin-1-ium
InChI:
InChI=1S/C6H4N2O2/c9-5-7-6-1-3-8(10)4-2-6/h1-4H
InChI Key:
ZSAWYEJXUQETBJ-UHFFFAOYSA-N
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.027g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.11g/mol
Monoisotopic Mass:
136.027g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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