| CAS Number | 887589-90-4 |
| Catalog Number | AG00IFGE(AGN-PC-0WONYU) |
| Chemical Name | Ethyl 5-cyclopentyl-3-oxopentanoate |
| IUPAC Name | ethyl 5-cyclopentyl-3-oxopentanoate |
| InChI | InChI=1S/C12H20O3/c1-2-15-12(14)9-11(13)8-7-10-5-3-4-6-10/h10H,2-9H2,1H3 |
| InChI Key | OGMBQZYQQMUAHZ-UHFFFAOYSA-N |
| MDL Number | MFCD07783809 |
| Molecular Formula | C12H20O3 |
| Molecular Weight | 212.2854 |
| SMILES | C1(CCCC1)CCC(CC(=O)OCC)=O |
| Synonyms | 887589-90-4,
ethyl 5-cyclopentyl-3-oxopentanoate,
Ethyl 5-cyclopentyl-3-oxo-pentanoate,
BETA-OXO-CYCLOPENTANEPENTANOIC ACID ETHYL ESTER,
SCHEMBL5313576,
CTK6F8251,
OGMBQZYQQMUAHZ-UHFFFAOYSA-N,
KS-00001KL0,
MFCD07783809,
ZINC21985679,
AKOS015961891,
AS-40075,
5-cyclopentyl-3-oxo-pentanoic acid ethyl ester,
|
| Complexity | 217 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.141g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.289g/mol |
| Monoisotopic Mass | 212.141g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 43.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number