| CAS Number | 1191453-82-3 |
| Catalog Number | AG0094LG |
| Chemical Name | Methyl 2-bromo-3-cyclopentylpropionate |
| IUPAC Name | methyl 2-bromo-3-cyclopentylpropanoate |
| InChI | InChI=1S/C9H15BrO2/c1-12-9(11)8(10)6-7-4-2-3-5-7/h7-8H,2-6H2,1H3 |
| InChI Key | IBRYTPZFAFCZGH-UHFFFAOYSA-N |
| MDL Number | MFCD16660241 |
| Molecular Formula | C9H15BrO2 |
| Molecular Weight | 235.1182 |
| SMILES | BrC(C(=O)OC)CC1CCCC1 |
| Synonyms | 1191453-82-3,
methyl 2-bromo-3-cyclopentylpropanoate,
Methyl 2-bromo-3-cyclopentylpropionate,
Alpha-Bromo-cyclopentanepropanoic acidmethylester,
SCHEMBL1008660,
IBRYTPZFAFCZGH-UHFFFAOYSA-N,
MFCD16660241,
AKOS022177440,
CS-W020470,
AS-39936,
2-bromo-3-cyclopentyl-propionic acid methyl ester,
|
| Complexity | 153 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.121g/mol |
| Monoisotopic Mass | 234.026g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number