| CAS Number | 72715-12-9 |
| Catalog Number | AG01A3J9(AGN-PC-0WO7JN) |
| Chemical Name | Ethyl 3-Cyclopropyl-3-Hydroxypropanoate |
| IUPAC Name | ethyl 3-cyclopropyl-3-hydroxypropanoate |
| InChI | InChI=1S/C8H14O3/c1-2-11-8(10)5-7(9)6-3-4-6/h6-7,9H,2-5H2,1H3 |
| InChI Key | OCPBHCDHXMXFQW-UHFFFAOYSA-N |
| MDL Number | MFCD16749066 |
| Molecular Formula | C8H14O3 |
| Molecular Weight | 158.1950 |
| SMILES | CCOC(=O)CC(C1CC1)O |
| Synonyms | ethyl 3-cyclopropyl-3-hydroxypropanoate,
72715-12-9,
SCHEMBL10990788,
AKOS011680254,
NE23867,
|
| Complexity | 140 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 158.094g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 158.197g/mol |
| Monoisotopic Mass | 158.094g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number