| CAS Number | 853917-76-7 |
| Catalog Number | AG01EXSP(AGN-PC-3H48D9) |
| Chemical Name | 4-(2-Methyl-octyl)-pyridine |
| IUPAC Name | 4-(2-methyloctyl)pyridine |
| InChI | InChI=1S/C14H23N/c1-3-4-5-6-7-13(2)12-14-8-10-15-11-9-14/h8-11,13H,3-7,12H2,1-2H3 |
| InChI Key | KNFNPLAXQNYYKE-UHFFFAOYSA-N |
| MDL Number | MFCD06637724 |
| Molecular Formula | C14H23N |
| Molecular Weight | 205.3391 |
| SMILES | C1(CC(CCCCCC)C)=CC=NC=C1 |
| Synonyms | 4-(2-Methyl-octyl)-pyridine,
853917-76-7,
4-(2-methyloctyl)pyridine,
SCHEMBL20780670,
CTK6D7463,
AKOS024388295,
MCULE-4685486490,
ST51042352,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.183g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.345g/mol |
| Monoisotopic Mass | 205.183g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.2 |
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Certificate of Analysis
Lot Number