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1246648-80-5

1246648-80-5 | 1-(6-Nitro-1,3-benzodioxol-5-yl)-1H-imidazole

CAS No: 1246648-80-5 Catalog No: AG00HHR4 MDL No:

Product Description

Catalog Number:
AG00HHR4
Chemical Name:
1-(6-Nitro-1,3-benzodioxol-5-yl)-1H-imidazole
CAS Number:
1246648-80-5
IUPAC Name:
1-(6-nitro-1,3-benzodioxol-5-yl)imidazole
InChI:
InChI=1S/C10H7N3O4/c14-13(15)8-4-10-9(16-6-17-10)3-7(8)12-2-1-11-5-12/h1-5H,6H2
InChI Key:
PBBZTWZMOGNBAI-UHFFFAOYSA-N

Properties

Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.044g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.183g/mol
Monoisotopic Mass:
233.044g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
82.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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