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Home > Imidazoles > 23309-09-3
23309-09-3 | 1H-Imidazole, 1-(3-nitrophenyl)-
CAS No: 23309-09-3 Catalog No: AG002MVB MDL No:MFCD01795847
Product Description
Catalog Number:
AG002MVB
Chemical Name:
1H-Imidazole, 1-(3-nitrophenyl)-
CAS Number:
23309-09-3
Molecular Formula:
C9H7N3O2
Molecular Weight:
189.1708
MDL Number:
MFCD01795847
IUPAC Name:
1-(3-nitrophenyl)imidazole
InChI:
InChI=1S/C9H7N3O2/c13-12(14)9-3-1-2-8(6-9)11-5-4-10-7-11/h1-7H
InChI Key:
NUIYHMRBFZOEES-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)n1cncc1
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.054g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.174g/mol
Monoisotopic Mass:
189.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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