| CAS Number | 936497-97-1 |
| Catalog Number | AG01AKPD(AGN-PC-0WNNR3) |
| Chemical Name | 4-chloro-8-methyl-quinoline-3-carbonitrile |
| IUPAC Name | 4-chloro-8-methylquinoline-3-carbonitrile |
| InChI | InChI=1S/C11H7ClN2/c1-7-3-2-4-9-10(12)8(5-13)6-14-11(7)9/h2-4,6H,1H3 |
| InChI Key | OKDNVIMPGYPSIH-UHFFFAOYSA-N |
| MDL Number | MFCD09261373 |
| Molecular Formula | C11H7ClN2 |
| Molecular Weight | 202.6397 |
| SMILES | CC1=C2C(C(=C(C=N2)C#N)Cl)=CC=C1 |
| Synonyms | 4-chloro-8-methylquinoline-3-carbonitrile,
936497-97-1,
4-Chloro-8-methyl-quinoline-3-carbonitrile,
EN300-84824,
MFCD09261373,
ZINC16697604,
AKOS000190065,
BBV-081937,
FCH5613736,
AS-37335,
|
| Complexity | 257 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.03g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.641g/mol |
| Monoisotopic Mass | 202.03g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 36.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number