| CAS Number | 177158-21-3 |
| Catalog Number | AG00AQBK(AGN-PC-0O50KT) |
| Chemical Name | N-[(3S)-TETRAHYDRO-2-OXO-3-FURANYL]-NONANAMIDE |
| IUPAC Name | N-[(3S)-2-oxooxolan-3-yl]nonanamide |
| InChI | InChI=1S/C13H23NO3/c1-2-3-4-5-6-7-8-12(15)14-11-9-10-17-13(11)16/h11H,2-10H2,1H3,(H,14,15)/t11-/m0/s1 |
| InChI Key | OMPXHNXRUVEQDO-NSHDSACASA-N |
| MDL Number | MFCD11976920 |
| Molecular Formula | C13H23NO3 |
| Molecular Weight | 241.3266 |
| SMILES | CCCCCCCCC(=O)N[C@H]1CCOC1=O |
| Synonyms | N-nonanoyl-L-Homoserine lactone,
177158-21-3,
N-[(3S)-Tetrahydro-2-oxo-3-furanyl]nonanamide,
SCHEMBL5177263,
CHEMBL1823929,
OMPXHNXRUVEQDO-NSHDSACASA-N,
1940AH,
ZINC64857990,
J-011255,
N-[(3S)-TETRAHYDRO-2-OXO-3-FURANYL]-NONANAMIDE,
C13H23NO3,
|
| Complexity | 253 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.168g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.331g/mol |
| Monoisotopic Mass | 241.168g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 55.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number