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137521-47-2 | Butanamide, N-methyl-3-oxo-2-(2-phenylhydrazinylidene)-
CAS No: 137521-47-2 Catalog No: AG0013H2 MDL No:
Product Description
Catalog Number:
AG0013H2
Chemical Name:
Butanamide, N-methyl-3-oxo-2-(2-phenylhydrazinylidene)-
CAS Number:
137521-47-2
Molecular Formula:
C11H13N3O2
Molecular Weight:
219.2398
IUPAC Name:
3-hydroxy-N-methyl-2-phenyldiazenylbut-2-enamide
InChI:
InChI=1S/C11H13N3O2/c1-8(15)10(11(16)12-2)14-13-9-6-4-3-5-7-9/h3-7,15H,1-2H3,(H,12,16)
InChI Key:
LJGJOYJMVOLJJK-UHFFFAOYSA-N
SMILES:
CNC(=O)C(=NNc1ccccc1)C(=O)C
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.101g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
219.244g/mol
Monoisotopic Mass:
219.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
74A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.3
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