| CAS Number | 183555-60-4 |
| Catalog Number | AG01FR4T(AGN-PC-03MESP) |
| Chemical Name | N,N,2-Trimethyl-3-nitroaniline |
| IUPAC Name | N,N,2-trimethyl-3-nitroaniline |
| InChI | InChI=1S/C9H12N2O2/c1-7-8(10(2)3)5-4-6-9(7)11(12)13/h4-6H,1-3H3 |
| InChI Key | KPUSVKGMJNXHTC-UHFFFAOYSA-N |
| MDL Number | MFCD28363962 |
| Molecular Formula | C9H12N2O2 |
| Molecular Weight | 180.2038 |
| SMILES | |
| Synonyms | N,N,2-trimethyl-3-nitroaniline,
183555-60-4,
SCHEMBL5154292,
KPUSVKGMJNXHTC-UHFFFAOYSA-N,
N,N-dimethyl-2-methyl-3-nitroaniline,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.089878g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.2g/mol |
| Monoisotopic Mass | 180.089878g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 49.1Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number