| CAS Number | 49847-47-4 |
| Catalog Number | AG01DX5W(AGN-PC-0NDF4C) |
| Chemical Name | 2-(Bromomethyl)-2-methyloxirane |
| IUPAC Name | 2-(bromomethyl)-2-methyloxirane |
| InChI | InChI=1S/C4H7BrO/c1-4(2-5)3-6-4/h2-3H2,1H3 |
| InChI Key | KLIGCFPMFRTVFR-UHFFFAOYSA-N |
| MDL Number | MFCD20621818 |
| Molecular Formula | C4H7BrO |
| Molecular Weight | 151.0018 |
| SMILES | CC1(OC1)CBr |
| Synonyms | 2-(bromomethyl)-2-methyloxirane,
49847-47-4,
2-bromomethyl-2-methyl-oxirane,
SCHEMBL9339560,
2-Methyl-2-(bromomethyl)oxirane,
SY247742,
MFCD20621818 (95%),
2-(bromomethyl)-2-methyl-oxirane,
CID10953698,
|
| Complexity | 64.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 149.968g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 6 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 151.003g/mol |
| Monoisotopic Mass | 149.968g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12.5A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number