| CAS Number | 38284-47-8 |
| Catalog Number | AG00C9GT(AGN-PC-0WBNNB) |
| Chemical Name | 4-(2-(2-(6,6-Dimethylbicyclo[3.1.1]heptan-2-yl)ethoxy)ethyl)morpholine |
| EC Number | 609-541-2 |
| IUPAC Name | 4-[2-[2-(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)ethoxy]ethyl]morpholine |
| InChI | InChI=1S/C17H31NO2/c1-17(2)15-4-3-14(16(17)13-15)5-9-19-10-6-18-7-11-20-12-8-18/h14-16H,3-13H2,1-2H3 |
| InChI Key | FPLHEALBGYMFJM-UHFFFAOYSA-N |
| MDL Number | MFCD21363776 |
| Molecular Formula | C17H31NO2 |
| Molecular Weight | 281.4335 |
| SMILES | CC1(C)[C@@H]2[C@@H](CCOCCN3CCOCC3)CC[C@H]1C2 |
| Synonyms | 38284-47-8,
4-[2-(2-{6,6-dimethylbicyclo[3.1.1]heptan-2-yl}ethoxy)ethyl]morpholine,
4-[2-[2-(6,6-Dimethylbicyclo[3.1.1]heptan-2-yl)ethoxy]ethyl]morpholine,
AC1MHIGQ,
SS-5173,
4-[2-[2-(6,6-dimethyl-4-bicyclo[3.1.1]heptanyl)ethoxy]ethyl]morpholine,
(1S,2S,5S)-4-[2-[2-(6,6-Dimethylbicyclo[3.1.1]hept-2-yl)ethoxy]ethyl]morpholine,
FPLHEALBGYMFJM-UHFFFAOYSA-N,
CID3052016,
4-(2-(2-(6,6-dimethylbicyclo[3.1.1] heptan-2-yl)ethoxy)ethyl)morpholine,
4-[2-[2-(7,7-dimethyl-2-bicyclo[3.1.1]heptyl)ethoxy]ethyl]morpholine,
|
| Complexity | 312 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 281.235g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 281.44g/mol |
| Monoisotopic Mass | 281.235g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 21.7A^2 |
| Undefined Atom Stereocenter Count | 3 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number