| Typical physical and chemical properties | |
|---|---|
| Catalog Number | ACM7005723-1 |
| Product Name | 4-Chlorodiphenyl ether |
| CAS | 7005-72-3 |
| Structure |  |
| Synonyms | 4-Chlorophenyl phenyl ether |
| IUPAC Name | 1-Chloro-4-phenoxybenzene |
| Molecular Weight | 204.65 |
| Molecular Formula | C12H9ClO |
| Canonical SMILES | C1=CC=C(C=C1)OC2=CC=C(C=C2)Cl |
| InChI | InChI=1S/C12H9ClO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H |
| InChIKey | PGPNJCAMHOJTEF-UHFFFAOYSA-N |
| Boiling Point | 161-162 °C |
| Melting Point | -8 °C |
| Flash Point | >230 °F |
| Density | 1.193 g/mL |
| Complexity | 158 |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.0341926 |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Monoisotopic Mass | 204.0341926 |
| Physical State | Liquid |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 9.2 Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| MSDS | Download MSDS |
| COA | Download COA |
| Spec Sheet | Download Spec Sheet |
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