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61587-95-9

61587-95-9 | 1H-Benzimidazole-4,7-dione,5,6-dimethyl-(9CI)

CAS No: 61587-95-9 Catalog No: AG00EW7K MDL No:

Product Description

Catalog Number:
AG00EW7K
Chemical Name:
1H-Benzimidazole-4,7-dione,5,6-dimethyl-(9CI)
CAS Number:
61587-95-9
IUPAC Name:
5,6-dimethyl-1H-benzimidazole-4,7-dione
InChI:
InChI=1S/C9H8N2O2/c1-4-5(2)9(13)7-6(8(4)12)10-3-11-7/h3H,1-2H3,(H,10,11)
InChI Key:
OAGOGQAXEVPPEB-UHFFFAOYSA-N

Properties

Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.059g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
176.175g/mol
Monoisotopic Mass:
176.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

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