| CAS Number | 1038700-63-8 |
| Catalog Number | AG003T65(AGN-PC-0WD0NG) |
| Chemical Name | N-Methyl-2-(2-nitrophenoxy)ethanamine |
| IUPAC Name | N-methyl-2-(2-nitrophenoxy)ethanamine |
| InChI | InChI=1S/C9H12N2O3/c1-10-6-7-14-9-5-3-2-4-8(9)11(12)13/h2-5,10H,6-7H2,1H3 |
| InChI Key | YWTUCZRYMNKHKT-UHFFFAOYSA-N |
| MDL Number | MFCD11053870 |
| Molecular Formula | C9H12N2O3 |
| Molecular Weight | 196.2032 |
| SMILES | CNCCOc1ccccc1[N+](=O)[O-] |
| Synonyms | N-Methyl-2-(2-nitrophenoxy)ethanamine,
1038700-63-8,
ACMC-20989o,
CTK4A2461,
DTXSID80651296,
ANW-14986,
MFCD11053870,
ZINC19776824,
AKOS009273125,
RTR-000897,
AJ-74871,
AX8229695,
N-Methyl-2-(2-nitrophenoxy)ethan-1-amine,
TR-000897,
ST24025660,
Z6698,
A-4298,
I05-714,
C9H12N2O3,
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| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.085g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.206g/mol |
| Monoisotopic Mass | 196.085g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 67.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number