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Home > Nitro Compounds > 76893-55-5
76893-55-5 | Pyridine,2-(2,3-dimethylphenoxy)-3-nitro-
CAS No: 76893-55-5 Catalog No: AG00587F MDL No:MFCD00096772
Product Description
Catalog Number:
AG00587F
Chemical Name:
Pyridine,2-(2,3-dimethylphenoxy)-3-nitro-
CAS Number:
76893-55-5
Molecular Formula:
C13H12N2O3
Molecular Weight:
244.2460
MDL Number:
MFCD00096772
IUPAC Name:
2-(2,3-dimethylphenoxy)-3-nitropyridine
InChI:
InChI=1S/C13H12N2O3/c1-9-5-3-7-12(10(9)2)18-13-11(15(16)17)6-4-8-14-13/h3-8H,1-2H3
InChI Key:
RNOWNESUZZSGDB-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccnc1Oc1cccc(c1C)C
NSC Number:
76787
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.085g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.25g/mol
Monoisotopic Mass:
244.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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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