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Home > Imidazoles > 87597-63-5
87597-63-5 | 1H-Imidazole-4-carboxamide, 5-(3-phenyl-1-triazenyl)-
CAS No: 87597-63-5 Catalog No: AG008EOE MDL No:
Product Description
Catalog Number:
AG008EOE
Chemical Name:
1H-Imidazole-4-carboxamide, 5-(3-phenyl-1-triazenyl)-
CAS Number:
87597-63-5
Molecular Formula:
C10H10N6O
Molecular Weight:
230.2260
IUPAC Name:
4-(anilinodiazenyl)-1H-imidazole-5-carboxamide
InChI:
InChI=1S/C10H10N6O/c11-9(17)8-10(13-6-12-8)15-16-14-7-4-2-1-3-5-7/h1-6H,(H2,11,17)(H,12,13)(H,14,15)
InChI Key:
ROOVMEITYLHLFW-UHFFFAOYSA-N
SMILES:
NC(=O)c1nc[nH]c1N=NNc1ccccc1
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.092g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
230.231g/mol
Monoisotopic Mass:
230.092g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.7
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