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94243-15-9 | 1,2,4-Triazine-5-carboxaldehyde, oxime
CAS No: 94243-15-9 Catalog No: AG006CWO MDL No:
Product Description
Catalog Number:
AG006CWO
Chemical Name:
1,2,4-Triazine-5-carboxaldehyde, oxime
CAS Number:
94243-15-9
Molecular Formula:
C4H4N4O
Molecular Weight:
124.1008
IUPAC Name:
N-(1,2,4-triazin-5-ylmethylidene)hydroxylamine
InChI:
InChI=1S/C4H4N4O/c9-8-2-4-1-6-7-3-5-4/h1-3,9H
InChI Key:
WCNDBLKEUQIRJH-UHFFFAOYSA-N
SMILES:
ON=Cc1cnncn1
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.039g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
124.103g/mol
Monoisotopic Mass:
124.039g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
-0.8
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