| CAS Number | 1936104-51-6 |
| Catalog Number | AG01B26P |
| Chemical Name | 3-(bromomethyl)-3-methoxyoxolane |
| IUPAC Name | 3-(bromomethyl)-3-methoxyoxolane |
| InChI | InChI=1S/C6H11BrO2/c1-8-6(4-7)2-3-9-5-6/h2-5H2,1H3 |
| InChI Key | IJJCVAQOXKZKAR-UHFFFAOYSA-N |
| MDL Number | MFCD29991564 |
| Molecular Formula | C6H11BrO2 |
| Molecular Weight | 195.0543 |
| SMILES | COC1(COCC1)CBr |
| Synonyms | 3-(bromomethyl)-3-methoxyoxolane,
1936104-51-6,
|
| Complexity | 97.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.994g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.056g/mol |
| Monoisotopic Mass | 193.994g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
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Certificate of Analysis
Lot Number