| CAS Number | 98648-34-1 |
| Catalog Number | AG0067BP(AGN-PC-09RN8O) |
| Chemical Name | N-Methyl-N-nitroso-1-hexadecylamine |
| IUPAC Name | N-hexadecyl-N-methylnitrous amide |
| InChI | InChI=1S/C17H36N2O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(2)18-20/h3-17H2,1-2H3 |
| InChI Key | CRWBBWJOAPFABB-UHFFFAOYSA-N |
| MDL Number | MFCD02258719 |
| Molecular Formula | C17H36N2O |
| Molecular Weight | 284.4805 |
| SMILES | CCCCCCCCCCCCCCCCN(C)N=O |
| Synonyms | 98648-34-1,
N-METHYL-N-NITROSO HEXADECYLAMINE,
N-Hexadecyl-N-methylnitrous amide,
N-Methyl-N-nitroso-1-hexadecanamine,
CTK5I0015,
DTXSID90694977,
ZINC97978818,
N-NITROSO-N-METHYLHEXADECYLAMINE,
N-METHYL-N-NITROSOHEXADECYLAMINE,
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| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 284.283g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 284.488g/mol |
| Monoisotopic Mass | 284.283g/mol |
| Rotatable Bond Count | 15 |
| Topological Polar Surface Area | 32.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 7.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number