| CAS Number | 879-52-7 |
| Catalog Number | AG01A3W2(AGN-PC-0VHWP9) |
| Chemical Name | Phenyl(1,3-thiazol-2-yl)methanol |
| IUPAC Name | phenyl(1,3-thiazol-2-yl)methanol |
| InChI | InChI=1S/C10H9NOS/c12-9(10-11-6-7-13-10)8-4-2-1-3-5-8/h1-7,9,12H |
| InChI Key | XHPLEXYGTGYCCO-UHFFFAOYSA-N |
| MDL Number | MFCD03211618 |
| Molecular Formula | C10H9NOS |
| Molecular Weight | 191.2496 |
| SMILES | OC(C1=CC=CC=C1)C1SC=CN=1 |
| Synonyms | Phenyl(1,3-thiazol-2-yl)methanol,
879-52-7,
phenyl(thiazol-2-yl)methanol,
2-Thiazolemethanol, .alpha.-phenyl-,
AC1LCRTE,
alpha-thiazolylbenzyl alcohol,
alpha-Phenylthiazole-2-methanol,
SCHEMBL6848050,
XHPLEXYGTGYCCO-UHFFFAOYSA-N,
AKOS003583028,
AKOS017356987,
Phenyl(1,3-thiazol-2-yl)methanol #,
MCULE-4538150860,
NE40216,
phenyl-thiazol-2-yl-methanol,
CID605604,
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| Complexity | 159 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.248g/mol |
| Monoisotopic Mass | 191.04g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 61.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number