| CAS Number | 99580-00-4 |
| Catalog Number | AG019JH6 |
| Chemical Name | 2-{[bis(4-fluorophenyl)methoxy]methyl}oxirane |
| IUPAC Name | 2-[bis(4-fluorophenyl)methoxymethyl]oxirane |
| InChI | InChI=1S/C16H14F2O2/c17-13-5-1-11(2-6-13)16(20-10-15-9-19-15)12-3-7-14(18)8-4-12/h1-8,15-16H,9-10H2 |
| InChI Key | PMNKNFRBIDZMGZ-UHFFFAOYSA-N |
| MDL Number | MFCD06357342 |
| Molecular Formula | C16H14F2O2 |
| Molecular Weight | 276.2780 |
| SMILES | FC1=CC=C(C(C2=CC=C(F)C=C2)OCC2OC2)C=C1 |
| Synonyms | 2-{[bis(4-fluorophenyl)methoxy]methyl}oxirane,
99580-00-4,
AC1MWO1X,
AC1Q4M0L,
SCHEMBL7324749,
CTK7B9889,
AKOS030694868,
MCULE-6247153802,
NE32367,
2-[bis(4-fluorophenyl)methoxymethyl]oxirane,
EN300-09439,
ZINC03389567,
CID3752343,
|
| Complexity | 275 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 276.096g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 276.283g/mol |
| Monoisotopic Mass | 276.096g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 21.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number