| CAS Number | 1021031-79-7 |
| Catalog Number | AG019TFM(AGN-PC-0WO402) |
| Chemical Name | {2-[(oxolan-2-yl)methoxy]phenyl}methanol |
| IUPAC Name | [2-(oxolan-2-ylmethoxy)phenyl]methanol |
| InChI | InChI=1S/C12H16O3/c13-8-10-4-1-2-6-12(10)15-9-11-5-3-7-14-11/h1-2,4,6,11,13H,3,5,7-9H2 |
| InChI Key | IGKCJUNAEKKZBU-UHFFFAOYSA-N |
| MDL Number | MFCD11149628 |
| Molecular Formula | C12H16O3 |
| Molecular Weight | 208.2536 |
| SMILES | OCC1=C(OCC2OCCC2)C=CC=C1 |
| Synonyms | [2-(oxolan-2-ylmethoxy)phenyl]methanol,
1021031-79-7,
SCHEMBL2346726,
AKOS000247742,
MCULE-7530546063,
NE36220,
{2-[(oxolan-2-yl)methoxy]phenyl}methanol,
Z428696510,
|
| Complexity | 184 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.257g/mol |
| Monoisotopic Mass | 208.11g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.7A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number