| CAS Number | 1353877-92-5 |
| Catalog Number | AG00ISM8(AGN-PC-0WAZMK) |
| Chemical Name | 2-Chloro-5-ethynyl-3-iodo-4-pyridinamine |
| IUPAC Name | 2-chloro-5-ethynyl-3-iodopyridin-4-amine |
| InChI | InChI=1S/C7H4ClIN2/c1-2-4-3-11-7(8)5(9)6(4)10/h1,3H,(H2,10,11) |
| InChI Key | UHPHNEJXSVUMJX-UHFFFAOYSA-N |
| MDL Number | MFCD20921573 |
| Molecular Formula | C7H4ClIN2 |
| Molecular Weight | 278.4775 |
| SMILES | IC1(=C(Cl)N=CC(=C1N)C#C) |
| Synonyms | 2-chloro-5-ethynyl-3-iodo-4-pyridinamine,
1353877-92-5,
2-chloro-5-ethynyl-3-iodopyridin-4-amine,
chloroethynyliodopyridinamine,
KS-00001Q4Y,
ZX-RL003034,
MFCD20921573,
ZINC71788958,
AKOS015991447,
FCH1612796,
GD-0703,
MCULE-6420317859,
RP15410,
OR303816,
|
| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 277.911g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 278.477g/mol |
| Monoisotopic Mass | 277.911g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number