| CAS Number | 85984-22-1 |
| Catalog Number | AG019UPA |
| Chemical Name | 4-(2,6-dimethylmorpholin-4-yl)-3-fluoroaniline |
| IUPAC Name | 4-(2,6-dimethylmorpholin-4-yl)-3-fluoroaniline |
| InChI | InChI=1S/C12H17FN2O/c1-8-6-15(7-9(2)16-8)12-4-3-10(14)5-11(12)13/h3-5,8-9H,6-7,14H2,1-2H3 |
| InChI Key | FOXDRQYNTAHYRU-UHFFFAOYSA-N |
| MDL Number | MFCD10690948 |
| Molecular Formula | C12H17FN2O |
| Molecular Weight | 224.2746 |
| SMILES | CC1OC(C)CN(C2=C(F)C=C(N)C=C2)C1 |
| Synonyms | 4-(2,6-dimethylmorpholin-4-yl)-3-fluoroaniline,
85984-22-1,
AC1Q2RCH,
SCHEMBL16671146,
CTK6C5291,
FOXDRQYNTAHYRU-UHFFFAOYSA-N,
AKOS005214542,
MCULE-2878359212,
NE31631,
4-(2,6-dimethylmorpholino)-3-fluoroaniline,
EN300-42399,
Z426041644,
|
| Complexity | 229 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.132g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.279g/mol |
| Monoisotopic Mass | 224.132g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38.5A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number