| CAS Number | 68535-57-9 |
| Catalog Number | AG019RKE(AGN-PC-0MTZ3Y) |
| Chemical Name | 4-(1,3-Thiazol-4-yl)phenol |
| IUPAC Name | 4-(1,3-thiazol-4-yl)phenol |
| InChI | InChI=1S/C9H7NOS/c11-8-3-1-7(2-4-8)9-5-12-6-10-9/h1-6,11H |
| InChI Key | ZDXNEAWEPCZBQO-UHFFFAOYSA-N |
| MDL Number | MFCD17977224 |
| Molecular Formula | C9H7NOS |
| Molecular Weight | 177.2230 |
| SMILES | OC1=CC=C(C2N=CSC=2)C=C1 |
| Synonyms | 4-(1,3-thiazol-4-yl)phenol,
68535-57-9,
4-(thiazol-4-yl)phenol,
AC1Q78QI,
SCHEMBL496710,
4-(4-hydroxyphenyl) thiazole,
ZDXNEAWEPCZBQO-UHFFFAOYSA-N,
ZINC57219238,
AKOS022639691,
MCULE-4287543142,
NE57488,
EN300-89880,
Z1147474009,
CID9815385,
|
| Complexity | 146 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.221g/mol |
| Monoisotopic Mass | 177.025g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 61.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number