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1020242-98-1 | 1-(7-Nitro-2,3-dihydro-1,4-benzodioxin-6-yl)-1H-imidazole
CAS No: 1020242-98-1 Catalog No: AG00H9Q6 MDL No:
Product Description
Catalog Number:
AG00H9Q6
Chemical Name:
1-(7-Nitro-2,3-dihydro-1,4-benzodioxin-6-yl)-1H-imidazole
CAS Number:
1020242-98-1
IUPAC Name:
1-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)imidazole
InChI:
InChI=1S/C11H9N3O4/c15-14(16)9-6-11-10(17-3-4-18-11)5-8(9)13-2-1-12-7-13/h1-2,5-7H,3-4H2
InChI Key:
MNPACLWGEWTYAW-UHFFFAOYSA-N
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.059g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.21g/mol
Monoisotopic Mass:
247.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
82.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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