| CAS Number | 13524-74-8 |
| Catalog Number | AG01AI07(AGN-PC-0N3ER8) |
| Chemical Name | 2-Methyl-1-phenoxypropan-2-ol |
| IUPAC Name | 2-methyl-1-phenoxypropan-2-ol |
| InChI | InChI=1S/C10H14O2/c1-10(2,11)8-12-9-6-4-3-5-7-9/h3-7,11H,8H2,1-2H3 |
| InChI Key | AVDVAVVYHMRVBP-UHFFFAOYSA-N |
| MDL Number | MFCD12802474 |
| Molecular Formula | C10H14O2 |
| Molecular Weight | 166.2170 |
| SMILES | c1cccc(c1)OCC(O)(C)C |
| Synonyms | 2-methyl-1-phenoxypropan-2-ol,
13524-74-8,
SCHEMBL97005,
1,1-Dimethyl-2-phenoxyethanol,
1-Phenoxy-2-methyl-2-propanol,
AVDVAVVYHMRVBP-UHFFFAOYSA-N,
2-Propanol, 2-methyl-1-phenoxy-,
ZINC37695688,
AKOS008140581,
MCULE-5627021000,
NE21140,
EN300-76306,
2-methyl-1-phenoxy-2-propanol,
2-methyl-1-phenoxy-propan-2-ol,
CID10374790,
|
| Complexity | 126 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 166.22g/mol |
| Monoisotopic Mass | 166.099g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number