| CAS Number | 1049706-69-5 |
| Catalog Number | AG01A2TJ |
| Chemical Name | 6-Chloro-3-nitro-2-phenylpyridine |
| IUPAC Name | 6-chloro-3-nitro-2-phenylpyridine |
| InChI | InChI=1S/C11H7ClN2O2/c12-10-7-6-9(14(15)16)11(13-10)8-4-2-1-3-5-8/h1-7H |
| InChI Key | IGMJZXTVWRCLKZ-UHFFFAOYSA-N |
| MDL Number | MFCD21790369 |
| Molecular Formula | C11H7ClN2O2 |
| Molecular Weight | 234.6385 |
| SMILES | [O-][N+](C1=C(C2=CC=CC=C2)N=C(Cl)C=C1)=O |
| Synonyms | 6-chloro-3-nitro-2-phenylpyridine,
1049706-69-5,
SCHEMBL1201813,
IGMJZXTVWRCLKZ-UHFFFAOYSA-N,
6-Chloro-3-nitro-2-phenyl-pyridine,
ZINC83255493,
AKOS017624064,
NE38143,
A1-08520,
|
| Complexity | 251 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 234.639g/mol |
| Monoisotopic Mass | 234.02g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 58.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
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Certificate of Analysis
Lot Number