| CAS Number | 73697-60-6 |
| Catalog Number | AG005XY2(AGN-PC-0N7FG0) |
| Chemical Name | Ethyl 3-(oxiran-2-yl)propanoate |
| IUPAC Name | ethyl 3-(oxiran-2-yl)propanoate |
| InChI | InChI=1S/C7H12O3/c1-2-9-7(8)4-3-6-5-10-6/h6H,2-5H2,1H3 |
| InChI Key | MFZSRRBSNGQXRR-UHFFFAOYSA-N |
| MDL Number | MFCD24506227 |
| Molecular Formula | C7H12O3 |
| Molecular Weight | 144.1684 |
| SMILES | CCOC(CCC1OC1)=O |
| Synonyms | Ethyl 3-(oxiran-2-yl)propanoate,
73697-60-6,
Oxiranepropanoic acid, ethyl ester,
2-Oxiranepropanoic acid, ethyl ester,
SCHEMBL11323271,
CTK2G1719,
DTXSID60457511,
3-Oxiranylpropanoic acid ethyl ester,
CID11171042,
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| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 144.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.17g/mol |
| Monoisotopic Mass | 144.079g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 38.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
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Certificate of Analysis
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