| CAS Number | 714953-84-1 |
| Catalog Number | AG00IC6A |
| Chemical Name | 1-[Amino-(4-nitro-phenyl)-methyl]-naphthalen-2-ol hydrochloride |
| IUPAC Name | 1-[amino-(4-nitrophenyl)methyl]naphthalen-2-ol;hydrochloride |
| InChI | InChI=1S/C17H14N2O3.ClH/c18-17(12-5-8-13(9-6-12)19(21)22)16-14-4-2-1-3-11(14)7-10-15(16)20;/h1-10,17,20H,18H2;1H |
| InChI Key | PMQFOFOAHKGDFW-UHFFFAOYSA-N |
| MDL Number | MFCD07366591 |
| Molecular Formula | C17H15ClN2O3 |
| Molecular Weight | 330.7656 |
| SMILES | Oc1ccc2c(c1C(c1ccc(cc1)[N+](=O)[O-])N)cccc2.Cl |
| Synonyms | 714953-84-1,
1-[Amino-(4-nitro-phenyl)-methyl]-naphthalen-2-ol hydrochloride,
DTXSID10588728,
MFCD07366591,
OR307609,
RT-006509,
T6632,
1-[Amino(4-nitrophenyl)methyl]naphthalen-2-ol--hydrogen chloride (1/1),
1-[AMINO- -METHYL]-NAPHTHALEN-2-OLHYDROCHLORIDE,
1-[AMINO-(4-NITRO-PHENYL)-METHYL]-NAPHTHALEN-2-OL,
1-[Amino-(4-nitrophenyl)methyl]naphthalen-2-ol hydrochloride,
791586-37-3,
|
| Complexity | 390 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 330.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 330.768g/mol |
| Monoisotopic Mass | 330.077g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 92.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number