| CAS Number | 19935-80-9 |
| Catalog Number | AG01AUEN(AGN-PC-01UNY6) |
| Chemical Name | 1-(1-chloroethyl)-4-phenoxybenzene |
| IUPAC Name | 1-(1-chloroethyl)-4-phenoxybenzene |
| InChI | InChI=1S/C14H13ClO/c1-11(15)12-7-9-14(10-8-12)16-13-5-3-2-4-6-13/h2-11H,1H3 |
| InChI Key | JCDHEENRYMLUBK-UHFFFAOYSA-N |
| MDL Number | MFCD18353259 |
| Molecular Formula | C14H13ClO |
| Molecular Weight | 232.7054 |
| SMILES | CC(C1=CC=C(OC2=CC=CC=C2)C=C1)Cl |
| Synonyms | 1-(1-chloroethyl)-4-phenoxybenzene,
19935-80-9,
AKOS012737087,
|
| Complexity | 193 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.707g/mol |
| Monoisotopic Mass | 232.065g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number