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24621-52-1 | Diazenecarboxaldehyde, (4-methylphenyl)-, oxime (9CI)
CAS No: 24621-52-1 Catalog No: AG002OTY MDL No:
Product Description
Catalog Number:
AG002OTY
Chemical Name:
Diazenecarboxaldehyde, (4-methylphenyl)-, oxime (9CI)
CAS Number:
24621-52-1
Molecular Formula:
C8H9N3O
Molecular Weight:
163.1766
IUPAC Name:
N'-(4-methylanilino)-N-oxomethanimidamide
InChI:
InChI=1S/C8H9N3O/c1-7-2-4-8(5-3-7)11-9-6-10-12/h2-6,11H,1H3
InChI Key:
CIIZTJOVEILWBF-UHFFFAOYSA-N
SMILES:
ON=CN=Nc1ccc(cc1)C
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.075g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
163.18g/mol
Monoisotopic Mass:
163.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.6
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