| CAS Number | 1346242-31-6 |
| Catalog Number | AG009E1N(AGN-PC-0WBNNW) |
| Chemical Name | 3-Nitrophenyl ethyl(methyl)carbamate |
| IUPAC Name | (3-nitrophenyl) N-ethyl-N-methylcarbamate |
| InChI | InChI=1S/C10H12N2O4/c1-3-11(2)10(13)16-9-6-4-5-8(7-9)12(14)15/h4-7H,3H2,1-2H3 |
| InChI Key | DFECCKHSYUWCIJ-UHFFFAOYSA-N |
| MDL Number | MFCD26390683 |
| Molecular Formula | C10H12N2O4 |
| Molecular Weight | 224.2133 |
| SMILES | C(OC1=CC=CC([N+]([O-])=O)=C1)(=O)N(CC)C |
| UNII | 5EM63X2EYP |
| Synonyms | 3-Nitrophenyl ethyl(methyl)carbamate,
UNII-5EM63X2EYP,
5EM63X2EYP,
1346242-31-6,
Carbamic acid, N-ethyl-N-methyl-, 3-nitrophenyl ester,
Rivastigmine tartrate impurity, carbamate impurity- [USP],
(3-nitrophenyl) N-ethyl-N-methylcarbamate,
J-006567,
|
| Complexity | 264 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.216g/mol |
| Monoisotopic Mass | 224.08g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 75.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number