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Home > Imidazoles > 32902-21-9
32902-21-9 | (1-METHYL-1H-IMIDAZOL-2-YL)-(3-NITRO-PHENYL)-METHANONE
CAS No: 32902-21-9 Catalog No: AG00CJ8I MDL No:MFCD01007019
Product Description
Catalog Number:
AG00CJ8I
Chemical Name:
(1-METHYL-1H-IMIDAZOL-2-YL)-(3-NITRO-PHENYL)-METHANONE
CAS Number:
32902-21-9
Molecular Formula:
C11H9N3O3
Molecular Weight:
231.2075
MDL Number:
MFCD01007019
IUPAC Name:
(1-methylimidazol-2-yl)-(3-nitrophenyl)methanone
InChI:
InChI=1S/C11H9N3O3/c1-13-6-5-12-11(13)10(15)8-3-2-4-9(7-8)14(16)17/h2-7H,1H3
InChI Key:
CFHYMNXKRADXDK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)C(=O)c1nccn1C
Properties
Complexity:
316
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.064g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.211g/mol
Monoisotopic Mass:
231.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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