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1965308-68-2 | 5-Phenylpyrazine-2,3-dicarboxamidoxime
CAS No: 1965308-68-2 Catalog No: AG01FCTH MDL No:MFCD28166201
Product Description
Catalog Number:
AG01FCTH
Chemical Name:
5-Phenylpyrazine-2,3-dicarboxamidoxime
CAS Number:
1965308-68-2
Molecular Formula:
C12H12N6O2
Molecular Weight:
272.2627
MDL Number:
MFCD28166201
IUPAC Name:
2-N',3-N'-dihydroxy-5-phenylpyrazine-2,3-dicarboximidamide
InChI:
InChI=1S/C12H12N6O2/c13-11(17-19)9-10(12(14)18-20)16-8(6-15-9)7-4-2-1-3-5-7/h1-6,19-20H,(H2,13,17)(H2,14,18)
InChI Key:
VZXARHPXORXMBF-UHFFFAOYSA-N
SMILES:
O/N=C(/c1nc(cnc1/C(=N/O)/N)c1ccccc1)\N
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Exact Mass:
272.102g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
272.268g/mol
Monoisotopic Mass:
272.102g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
143A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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