| CAS Number | 365572-36-7 |
| Catalog Number | AG019X1P(AGN-PC-0NEWUH) |
| Chemical Name | 3-[4-(Propan-2-yloxy)phenyl]propan-1-ol |
| IUPAC Name | 3-(4-propan-2-yloxyphenyl)propan-1-ol |
| InChI | InChI=1S/C12H18O2/c1-10(2)14-12-7-5-11(6-8-12)4-3-9-13/h5-8,10,13H,3-4,9H2,1-2H3 |
| InChI Key | OINFBDTYTOUBIM-UHFFFAOYSA-N |
| MDL Number | MFCD08693169 |
| Molecular Formula | C12H18O2 |
| Molecular Weight | 194.2701 |
| SMILES | CC(OC1=CC=C(CCCO)C=C1)C |
| Synonyms | 3-[4-(propan-2-yloxy)phenyl]propan-1-ol,
365572-36-7,
SCHEMBL5355098,
CTK8A4024,
ZINC14504829,
AKOS000277366,
MCULE-4291240703,
NE26679,
EN300-53797,
AB01000679-01,
A1-24021,
3-[4-(propan-2-yloxy)phenyl]propan-1-ol, AldrichCPR,
Z818727346,
AC1Q1QP7,
CID11041647,
3-(4-propan-2-yloxyphenyl)propan-1-ol,
|
| Complexity | 137 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.13068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.27g/mol |
| Monoisotopic Mass | 194.13068g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 29.5Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number