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Home > Aldehydes > 241818-88-2
241818-88-2 | 2,1,3-BENZOXADIAZOLE-5-CARBOXALDEHYDE, 5-OXIME, 1-OXIDE
CAS No: 241818-88-2 Catalog No: AG00BLYG MDL No:
Product Description
Catalog Number:
AG00BLYG
Chemical Name:
2,1,3-BENZOXADIAZOLE-5-CARBOXALDEHYDE, 5-OXIME, 1-OXIDE
CAS Number:
241818-88-2
IUPAC Name:
(NZ)-N-[(1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl)methylidene]hydroxylamine
InChI:
InChI=1S/C7H5N3O3/c11-8-4-5-1-2-7-6(3-5)9-13-10(7)12/h1-4,11H/b8-4-
InChI Key:
OCRVAHGMCUFQFG-YWEYNIOJSA-N
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
179.033g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.135g/mol
Monoisotopic Mass:
179.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
84.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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