| CAS Number | 920501-63-9 |
| Catalog Number | AG01AAUW(AGN-PC-0VXWPI) |
| Chemical Name | Cyclobutyl(4-fluorophenyl)methanamine |
| IUPAC Name | cyclobutyl-(4-fluorophenyl)methanamine |
| InChI | InChI=1S/C11H14FN/c12-10-6-4-9(5-7-10)11(13)8-2-1-3-8/h4-8,11H,1-3,13H2 |
| InChI Key | URHZIKVJKQVHEV-UHFFFAOYSA-N |
| MDL Number | MFCD09806866 |
| Molecular Formula | C11H14FN |
| Molecular Weight | 179.2340 |
| SMILES | NC(C1=CC=C(F)C=C1)C1CCC1 |
| Synonyms | cyclobutyl(4-fluorophenyl)methanamine,
920501-63-9,
Benzenemethanamine, alpha-cyclobutyl-4-fluoro-,
AC1Q507G,
SCHEMBL2790915,
AKOS000169549,
AKOS016903200,
MCULE-6778784910,
NE31242,
EN300-69647,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.238g/mol |
| Monoisotopic Mass | 179.111g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number