| CAS Number | 2044745-25-5 |
| Catalog Number | AG01BVRB |
| Chemical Name | ethyl 2-cyclopropanecarbonyl-4-cyclopropyl-4-oxobutanoate |
| IUPAC Name | ethyl 2-(cyclopropanecarbonyl)-4-cyclopropyl-4-oxobutanoate |
| InChI | InChI=1S/C13H18O4/c1-2-17-13(16)10(12(15)9-5-6-9)7-11(14)8-3-4-8/h8-10H,2-7H2,1H3 |
| InChI Key | GAPWDXROWIXFRP-UHFFFAOYSA-N |
| MDL Number | MFCD30486601 |
| Molecular Formula | C13H18O4 |
| Molecular Weight | 238.2796 |
| SMILES | CCOC(C(C(C1CC1)=O)CC(C1CC1)=O)=O |
| Synonyms | ethyl 2-cyclopropanecarbonyl-4-cyclopropyl-4-oxobutanoate,
2044745-25-5,
|
| Complexity | 339 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 238.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 238.283g/mol |
| Monoisotopic Mass | 238.121g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 60.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number