| CAS Number | 1807901-44-5 |
| Catalog Number | AG01BFHV(AGN-PC-0WOR3O) |
| Chemical Name | (1r,3r)-1-bromo-3-methoxycyclobutane |
| IUPAC Name | 1-bromo-3-methoxycyclobutane |
| InChI | InChI=1S/C5H9BrO/c1-7-5-2-4(6)3-5/h4-5H,2-3H2,1H3 |
| InChI Key | YBVXRWXSBZVVRL-UHFFFAOYSA-N |
| MDL Number | MFCD28118603 |
| Molecular Formula | C5H9BrO |
| Molecular Weight | 165.0284 |
| SMILES | CO[C@@H]1C[C@@H](Br)C1 |
| Synonyms | 1-bromo-3-methoxycyclobutane,
(1r,3r)-1-bromo-3-methoxycyclobutane,
1510635-41-2,
1807901-44-5,
1-bromo-3-methoxycyclobutane, cis,
ZINC85513835,
AKOS015690394,
AKOS026741496,
ZINC100557248,
ZINC238857092,
NE49486,
CS-0077320,
2044705-32-8,
1-Bromo-3-methoxy-cyclobutane,
|
| Complexity | 59.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 163.984g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.03g/mol |
| Monoisotopic Mass | 163.984g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number