| CAS Number | 1250339-07-1 |
| Catalog Number | AG01BHOS(AGN-PC-0WOW5W) |
| Chemical Name | [5-Chloro-2-(morpholin-4-yl)phenyl]methanamine |
| IUPAC Name | (5-chloro-2-morpholin-4-ylphenyl)methanamine |
| InChI | InChI=1S/C11H15ClN2O/c12-10-1-2-11(9(7-10)8-13)14-3-5-15-6-4-14/h1-2,7H,3-6,8,13H2 |
| InChI Key | LMPJCCDTRNQWPT-UHFFFAOYSA-N |
| MDL Number | MFCD16769528 |
| Molecular Formula | C11H15ClN2O |
| Molecular Weight | 226.7026 |
| SMILES | NCC1=C(N2CCOCC2)C=CC(Cl)=C1 |
| Synonyms | [5-chloro-2-(morpholin-4-yl)phenyl]methanamine,
1250339-07-1,
ZINC52856493,
AKOS011781890,
|
| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.087g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.704g/mol |
| Monoisotopic Mass | 226.087g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
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Certificate of Analysis
Lot Number