| CAS Number | 222405-29-0 |
| Catalog Number | AG01A2V8(AGN-PC-0WOCU7) |
| Chemical Name | 2-(p-Tolyl)tetrahydro-2H-pyran-4-ol |
| IUPAC Name | 2-(4-methylphenyl)oxan-4-ol |
| InChI | InChI=1S/C12H16O2/c1-9-2-4-10(5-3-9)12-8-11(13)6-7-14-12/h2-5,11-13H,6-8H2,1H3 |
| InChI Key | GYILWGJBECAIGJ-UHFFFAOYSA-N |
| MDL Number | MFCD19650637 |
| Molecular Formula | C12H16O2 |
| Molecular Weight | 192.2542 |
| SMILES | C1(=CC=C(C=C1)C1OCCC(C1)O)C |
| Synonyms | 2-(4-methylphenyl)oxan-4-ol,
222405-29-0,
2-(p-Tolyl)tetrahydro-2H-pyran-4-ol,
AKOS013421900,
NE41674,
2-(4-Methylphenyl)tetrahydro-2H-pyran-4-ol,
|
| Complexity | 173 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 192.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 192.258g/mol |
| Monoisotopic Mass | 192.115g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number