| CAS Number | 2007908-54-3 |
| Catalog Number | AG01EFNM |
| Chemical Name | N-Methoxy-N-methylchroman-2-carboxamide |
| IUPAC Name | N-methoxy-N-methyl-3,4-dihydro-2H-chromene-2-carboxamide |
| InChI | InChI=1S/C12H15NO3/c1-13(15-2)12(14)11-8-7-9-5-3-4-6-10(9)16-11/h3-6,11H,7-8H2,1-2H3 |
| InChI Key | KXBZCDJGDWILSE-UHFFFAOYSA-N |
| MDL Number | MFCD30472055 |
| Molecular Formula | C12H15NO3 |
| Molecular Weight | 221.2524 |
| SMILES | CON(C)C(=O)C1CCc2ccccc2O1 |
| Synonyms | N-Methoxy-N-methylchroman-2-carboxamide,
2007908-54-3,
MFCD30472055,
AKOS030628335,
CS-0039385,
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| Complexity | 257 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.105g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.256g/mol |
| Monoisotopic Mass | 221.105g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
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