| CAS Number | 6998-10-3 |
| Catalog Number | AG00FVAR(AGN-PC-0JKH21) |
| Chemical Name | N-Phenyloctanamide |
| IUPAC Name | N-phenyloctanamide |
| InChI | InChI=1S/C14H21NO/c1-2-3-4-5-9-12-14(16)15-13-10-7-6-8-11-13/h6-8,10-11H,2-5,9,12H2,1H3,(H,15,16) |
| InChI Key | UQLCRQPLVWWHDC-UHFFFAOYSA-N |
| MDL Number | MFCD00447797 |
| Molecular Formula | C14H21NO |
| Molecular Weight | 219.3226 |
| SMILES | C1(=CC=CC=C1)NC(CCCCCCC)=O |
| Synonyms | N-phenyloctanamide,
Octanilide,
OCTANANILIDE,
Caprylanilide,
Caprylic acid anilide,
Octanamide, N-phenyl-,
6998-10-3,
BRN 2097148,
hexylacetanilide,
N-Phenyloctaneamide,
AC1L2MBV,
N-phenyl-octanoic acid amide,
SCHEMBL3924103,
DTXSID60220247,
AKOS003482024,
LS-97842,
4-12-00-00395 (Beilstein Handbook Reference),
CID23428,
|
| Complexity | 185 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.162g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.328g/mol |
| Monoisotopic Mass | 219.162g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number