| CAS Number | 1177314-67-8 |
| Catalog Number | AG019PIV(AGN-PC-0WOT36) |
| Chemical Name | 2-amino-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carbonitrile hydrochloride |
| IUPAC Name | 2-amino-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carbonitrile;hydrochloride |
| InChI | InChI=1S/C8H9N3S.ClH/c9-3-6-5-1-2-11-4-7(5)12-8(6)10;/h11H,1-2,4,10H2;1H |
| InChI Key | RFULQEOTEDORJY-UHFFFAOYSA-N |
| MDL Number | MFCD07843131 |
| Molecular Formula | C8H10ClN3S |
| Molecular Weight | 215.7031 |
| SMILES | Cl.NC1=C(C#N)C2=C(CNCC2)S1 |
| Synonyms | 2-amino-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carbonitrile hydrochloride,
1177314-67-8,
EN300-23855,
2-amino-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carbonitrile hydrochloride,
AC1Q3CWA,
CTK7C6679,
AKOS026742887,
MCULE-8341767214,
NE47541,
Z166652142,
|
| Complexity | 222 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.028g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.699g/mol |
| Monoisotopic Mass | 215.028g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 90.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number