| CAS Number | 1017396-25-6 |
| Catalog Number | AG01B665 |
| Chemical Name | 2-(3-Chlorophenyl)-5,5-dimethylmorpholine |
| IUPAC Name | 2-(3-chlorophenyl)-5,5-dimethylmorpholine |
| InChI | InChI=1S/C12H16ClNO/c1-12(2)8-15-11(7-14-12)9-4-3-5-10(13)6-9/h3-6,11,14H,7-8H2,1-2H3 |
| InChI Key | OFJQFAKNSFCCTE-UHFFFAOYSA-N |
| MDL Number | MFCD09901507 |
| Molecular Formula | C12H16ClNO |
| Molecular Weight | 225.7145 |
| SMILES | CC1(NCC(C2=CC(Cl)=CC=C2)OC1)C |
| Synonyms | 2-(3-chlorophenyl)-5,5-dimethylmorpholine,
1017396-25-6,
MFCD09901507,
AKOS009386670,
MCULE-8762093586,
NS-02826,
|
| Complexity | 220 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 225.716g/mol |
| Monoisotopic Mass | 225.092g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number