| CAS Number | 936344-72-8 |
| Catalog Number | AG00IHPS |
| Chemical Name | Ethyl 2-amino-6-chloronicotinate |
| IUPAC Name | ethyl 2-amino-6-chloropyridine-3-carboxylate |
| InChI | InChI=1S/C8H9ClN2O2/c1-2-13-8(12)5-3-4-6(9)11-7(5)10/h3-4H,2H2,1H3,(H2,10,11) |
| InChI Key | JBNGZIXONGGHIT-UHFFFAOYSA-N |
| MDL Number | MFCD11501915 |
| Molecular Formula | C8H9ClN2O2 |
| Molecular Weight | 200.6223 |
| SMILES | CCOC(C1=C(N)N=C(Cl)C=C1)=O |
| Synonyms | ETHYL 2-AMINO-6-CHLORONICOTINATE,
936344-72-8,
SCHEMBL510186,
JBNGZIXONGGHIT-UHFFFAOYSA-N,
AR2612,
MFCD11501915,
ZINC35287632,
AKOS027334928,
AS-45399,
2-Amino-6-chloro-nicotinic acid ethyl ester,
ethyl 2-amino-6-chloropyridine-3-carboxylate,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.622g/mol |
| Monoisotopic Mass | 200.035g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 65.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number