| CAS Number | 625437-37-8 |
| Catalog Number | AG01B0BY(AGN-PC-01684G) |
| Chemical Name | N-[(2,6-difluorophenyl)methyl]cyclopropanamine |
| IUPAC Name | N-[(2,6-difluorophenyl)methyl]cyclopropanamine |
| InChI | InChI=1S/C10H11F2N/c11-9-2-1-3-10(12)8(9)6-13-7-4-5-7/h1-3,7,13H,4-6H2 |
| InChI Key | PJJAYNMZLKUGNZ-UHFFFAOYSA-N |
| MDL Number | MFCD09739918 |
| Molecular Formula | C10H11F2N |
| Molecular Weight | 183.1978 |
| SMILES | FC1=C(CNC2CC2)C(F)=CC=C1 |
| Synonyms | N-(2,6-DIFLUOROBENZYL)CYCLOPROPANAMINE,
625437-37-8,
N-[(2,6-difluorophenyl)methyl]cyclopropanamine,
SCHEMBL2469241,
CTK7C2232,
PJJAYNMZLKUGNZ-UHFFFAOYSA-N,
KS-00003TB5,
ZINC22223213,
AKOS000147415,
Cyclopropyl-(2,6-difluorobenzyl)amine,
NE23207,
TS-02550,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.086g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.202g/mol |
| Monoisotopic Mass | 183.086g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number