| CAS Number | 1183075-90-2 |
| Catalog Number | AG01A7XJ |
| Chemical Name | 1,2-Bis(3-fluorophenyl)ethan-1-amine |
| IUPAC Name | 1,2-bis(3-fluorophenyl)ethanamine |
| InChI | InChI=1S/C14H13F2N/c15-12-5-1-3-10(7-12)8-14(17)11-4-2-6-13(16)9-11/h1-7,9,14H,8,17H2 |
| InChI Key | QVJRANSSXJFNAZ-UHFFFAOYSA-N |
| MDL Number | MFCD12519740 |
| Molecular Formula | C14H13F2N |
| Molecular Weight | 233.2565 |
| SMILES | NC(C1=CC(F)=CC=C1)CC1=CC(F)=CC=C1 |
| Synonyms | 1,2-bis(3-fluorophenyl)ethan-1-amine,
1183075-90-2,
CTK7C1834,
AC1Q5092,
AKOS010037653,
MCULE-2396287101,
NE33008,
NCGC00337509-01,
EN300-60091,
AB01328621-02,
Z969563022,
|
| Complexity | 234 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.102g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.262g/mol |
| Monoisotopic Mass | 233.102g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number