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873-69-8 | Picolinaldehyde oxime
CAS No: 873-69-8 Catalog No: AG003U2I MDL No:MFCD00006354
Product Description
Catalog Number:
AG003U2I
Chemical Name:
Picolinaldehyde oxime
CAS Number:
873-69-8
Molecular Formula:
C6H6N2O
Molecular Weight:
122.1246
MDL Number:
MFCD00006354
IUPAC Name:
(NE)-N-(pyridin-2-ylmethylidene)hydroxylamine
InChI:
InChI=1S/C6H6N2O/c9-8-5-6-3-1-2-4-7-6/h1-5,9H/b8-5+
InChI Key:
MTFJSAGADRTKCI-VMPITWQZSA-N
SMILES:
O/N=C/c1ccccn1
EC Number:
212-849-6
UNII:
2WFO9N5MQE
NSC Number:
66484
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
122.048g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
122.127g/mol
Monoisotopic Mass:
122.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Literature
| Title | Journal |
|---|---|
| Investigation of the reactivation kinetics of a large series of bispyridinium oximes with organophosphate-inhibited human acetylcholinesterase. | Toxicology letters 20160226 |
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