| CAS Number | 24802-07-1 |
| Catalog Number | AG01FNJ2(AGN-PC-0R0K0S) |
| Chemical Name | alpha,alpha-Dimethyl-3-isopropenylbenzenemethanol |
| IUPAC Name | 2-(3-prop-1-en-2-ylphenyl)propan-2-ol |
| InChI | InChI=1S/C12H16O/c1-9(2)10-6-5-7-11(8-10)12(3,4)13/h5-8,13H,1H2,2-4H3 |
| InChI Key | UENHVTKPLPMSGQ-UHFFFAOYSA-N |
| MDL Number | MFCD32206300 |
| Molecular Formula | C12H16O |
| Molecular Weight | 176.2548 |
| SMILES | CC(O)(C1=CC(=CC=C1)C(=C)C)C |
| Synonyms | SCHEMBL4880904,
2-(m-Isopropenylphenyl)-2-propanol,
alpha,alpha-Dimethyl-3-isopropenylbenzenemethanol,
24802-07-1,
|
| Complexity | 193 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 176.12g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 176.259g/mol |
| Monoisotopic Mass | 176.12g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number