| CAS Number | 1018650-31-1 |
| Catalog Number | AG019WE9 |
| Chemical Name | N-(3-aminopropyl)-2-fluoro-N-methylaniline |
| IUPAC Name | N'-(2-fluorophenyl)-N'-methylpropane-1,3-diamine |
| InChI | InChI=1S/C10H15FN2/c1-13(8-4-7-12)10-6-3-2-5-9(10)11/h2-3,5-6H,4,7-8,12H2,1H3 |
| InChI Key | CTWCROAQADYWAQ-UHFFFAOYSA-N |
| MDL Number | MFCD10031317 |
| Molecular Formula | C10H15FN2 |
| Molecular Weight | 182.2379 |
| SMILES | CN(C1=C(F)C=CC=C1)CCCN |
| Synonyms | N-(3-aminopropyl)-2-fluoro-N-methylaniline,
1018650-31-1,
AC1Q3XGU,
CTK7E8185,
ZINC20239241,
AKOS008121909,
MCULE-2684357106,
NE35220,
EN300-51664,
|
| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 182.122g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 182.242g/mol |
| Monoisotopic Mass | 182.122g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number