| CAS Number | 189011-25-4 |
| Catalog Number | AG019M1I(AGN-PC-0L3IBH) |
| Chemical Name | 4-(1H-pyrrol-2-yl)-1,3-thiazol-2-amine |
| IUPAC Name | 4-(1H-pyrrol-2-yl)-1,3-thiazol-2-amine |
| InChI | InChI=1S/C7H7N3S/c8-7-10-6(4-11-7)5-2-1-3-9-5/h1-4,9H,(H2,8,10) |
| InChI Key | YGOKCJXCDGJCTN-UHFFFAOYSA-N |
| MDL Number | MFCD04614455 |
| Molecular Formula | C7H7N3S |
| Molecular Weight | 165.2156 |
| SMILES | NC1SC=C(C2NC=CC=2)N=1 |
| Synonyms | 4-(1H-pyrrol-2-yl)-1,3-thiazol-2-amine,
189011-25-4,
AC1N2CKY,
AC1Q52M9,
CTK7E1767,
ZINC3888866,
AKOS008946550,
MCULE-3648039230,
NE21583,
EN300-14221,
Z48847623,
ZINC03888866,
CID3995430,
|
| Complexity | 142 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 165.036g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.214g/mol |
| Monoisotopic Mass | 165.036g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 82.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number