| CAS Number | 1447734-06-6 |
| Catalog Number | AG019EKV(AGN-PC-0WG44H) |
| Chemical Name | Benzyl 2-Methyloxirane-2-Carboxylate |
| IUPAC Name | benzyl 2-methyloxirane-2-carboxylate |
| InChI | InChI=1S/C11H12O3/c1-11(8-14-11)10(12)13-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3 |
| InChI Key | HILAUPXKBRVORX-UHFFFAOYSA-N |
| MDL Number | MFCD29059375 |
| Molecular Formula | C11H12O3 |
| Molecular Weight | 192.2112 |
| SMILES | CC1(CO1)C(=O)OCc1ccccc1 |
| Synonyms | Benzyl 2-methyloxirane-2-carboxylate,
1447734-06-6,
MFCD29059375,
AKOS027338498,
CS-0037136,
Benzyl 2-Methyloxirane-2-Carboxylate(WXC01827),
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| Complexity | 221 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 192.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 192.214g/mol |
| Monoisotopic Mass | 192.079g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
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Certificate of Analysis
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