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107108-25-8 | 1H-Imidazole, 2-methyl-4-nitro-1-[(4-nitrophenyl)methyl]-
CAS No: 107108-25-8 Catalog No: AG007TF4 MDL No:
Product Description
Catalog Number:
AG007TF4
Chemical Name:
1H-Imidazole, 2-methyl-4-nitro-1-[(4-nitrophenyl)methyl]-
CAS Number:
107108-25-8
Molecular Formula:
C11H10N4O4
Molecular Weight:
262.2215
IUPAC Name:
2-methyl-4-nitro-1-[(4-nitrophenyl)methyl]imidazole
InChI:
InChI=1S/C11H10N4O4/c1-8-12-11(15(18)19)7-13(8)6-9-2-4-10(5-3-9)14(16)17/h2-5,7H,6H2,1H3
InChI Key:
UHXBMYIEUGRWLT-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)Cn1cc(nc1C)[N+](=O)[O-]
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.07g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.225g/mol
Monoisotopic Mass:
262.07g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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