| CAS Number | 374772-79-9 |
| Catalog Number | AG00C95D(AGN-PC-0IOMUR) |
| Chemical Name | Bisphenol F Bis(2-chloro-1-propanol) Ether(Mixture of Diastereomers) |
| IUPAC Name | 2-chloro-3-[4-[[4-(2-chloro-3-hydroxypropoxy)phenyl]methyl]phenoxy]propan-1-ol |
| InChI | InChI=1S/C19H22Cl2O4/c20-16(10-22)12-24-18-5-1-14(2-6-18)9-15-3-7-19(8-4-15)25-13-17(21)11-23/h1-8,16-17,22-23H,9-13H2 |
| InChI Key | VAFXFEBPCUMOIF-UHFFFAOYSA-N |
| MDL Number | MFCD30719814 |
| Molecular Formula | C19H22Cl2O4 |
| Molecular Weight | 385.2816 |
| SMILES | OCC(Cl)COc1ccc(Cc2ccc(OCC(Cl)CO)cc2)cc1 |
| Synonyms | Bisphenol F Bis(2-chloro-1-propanol) Ether,
374772-79-9,
BFDGE.2HCl,
SCHEMBL7087004,
DTXSID30741590,
FT-0663374,
3,3'-Methylenebis(1,4-phenyleneoxy)bis(2-chloropropane-1-ol),
3,3'-[Methylenebis(4,1-phenyleneoxy)]bis[2-chloro-1-propanol],
3,3'-{Methylenebis[(4,1-phenylene)oxy]}bis(2-chloropropan-1-ol),
VAFXFEBPCUMOIF-UHFFFAOYSA-N,
|
| Complexity | 310 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 384.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 385.281g/mol |
| Monoisotopic Mass | 384.09g/mol |
| Rotatable Bond Count | 10 |
| Topological Polar Surface Area | 58.9A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number