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125264-26-8 | 2-Thiazolecarbonitrile, N-oxide (9CI)
CAS No: 125264-26-8 Catalog No: AG00A6UY MDL No:
Product Description
Catalog Number:
AG00A6UY
Chemical Name:
2-Thiazolecarbonitrile, N-oxide (9CI)
CAS Number:
125264-26-8
IUPAC Name:
3-oxido-1,3-thiazol-3-ium-2-carbonitrile
InChI:
InChI=1S/C4H2N2OS/c5-3-4-6(7)1-2-8-4/h1-2H
InChI Key:
ALCVSOWBZBHQQX-UHFFFAOYSA-N
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.989g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.133g/mol
Monoisotopic Mass:
125.989g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
77.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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