| CAS Number | 494772-71-3 |
| Catalog Number | AG01AAVY(AGN-PC-03HNCZ) |
| Chemical Name | 2-[(4-Bromophenoxy)methyl]tetrahydrofuran
|
| IUPAC Name | 2-[(4-bromophenoxy)methyl]oxolane |
| InChI | InChI=1S/C11H13BrO2/c12-9-3-5-10(6-4-9)14-8-11-2-1-7-13-11/h3-6,11H,1-2,7-8H2 |
| InChI Key | PEFDJYPDPZQVGC-UHFFFAOYSA-N |
| MDL Number | MFCD09951726 |
| Molecular Formula | C11H13BrO2 |
| Molecular Weight | 257.1237 |
| SMILES | BrC1=CC=C(OCC2OCCC2)C=C1 |
| Synonyms | 2-(4-bromophenoxymethyl)oxolane,
494772-71-3,
AC1Q250N,
SCHEMBL1928209,
PEFDJYPDPZQVGC-UHFFFAOYSA-N,
2-[(4-bromophenoxy)methyl]oxolane,
AKOS000195372,
AKOS016873011,
MCULE-9886165505,
NE31705,
4-(Tetrahydrofuran-2-ylmethoxy)-bromobenzene,
EN300-69738,
Z54895783,
|
| Complexity | 167 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 256.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 257.127g/mol |
| Monoisotopic Mass | 256.01g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number