| CAS Number | 1087719-23-0 |
| Catalog Number | AG019YKN |
| Chemical Name | 2-(4-nitrophenyl)propan-2-amine hydrochloride |
| IUPAC Name | 2-(4-nitrophenyl)propan-2-amine;hydrochloride |
| InChI | InChI=1S/C9H12N2O2.ClH/c1-9(2,10)7-3-5-8(6-4-7)11(12)13;/h3-6H,10H2,1-2H3;1H |
| InChI Key | DLZQZCYMSGZZFX-UHFFFAOYSA-N |
| MDL Number | MFCD08689977 |
| Molecular Formula | C9H13ClN2O2 |
| Molecular Weight | 216.6647 |
| SMILES | Cl.CC(C1=CC=C([N+]([O-])=O)C=C1)(N)C |
| Synonyms | 2-(4-nitrophenyl)propan-2-amine hydrochloride,
1087719-23-0,
SCHEMBL3928206,
DLZQZCYMSGZZFX-UHFFFAOYSA-N,
AKOS025450660,
MCULE-7982339844,
2-(4-Nitrophenyl)-2-propylamine Hydrochloride,
W-1389,
alfa-alfa-Dimethyl-p-nitro-benzylamine hydrochloride,
Z1359429552,
|
| Complexity | 190 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.665g/mol |
| Monoisotopic Mass | 216.067g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 71.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number