| CAS Number | 1249444-92-5 |
| Catalog Number | AG01B05K(AGN-PC-0WOE86) |
| Chemical Name | N-Cyclobutyl-3-fluoroaniline |
| IUPAC Name | N-cyclobutyl-3-fluoroaniline |
| InChI | InChI=1S/C10H12FN/c11-8-3-1-6-10(7-8)12-9-4-2-5-9/h1,3,6-7,9,12H,2,4-5H2 |
| InChI Key | KFUHREDXJWKVAJ-UHFFFAOYSA-N |
| MDL Number | MFCD16107955 |
| Molecular Formula | C10H12FN |
| Molecular Weight | 165.2074 |
| SMILES | FC1=CC(NC2CCC2)=CC=C1 |
| Synonyms | N-cyclobutyl-3-fluoroaniline,
1249444-92-5,
SCHEMBL15772337,
KFUHREDXJWKVAJ-UHFFFAOYSA-N,
cyclobutyl-(3-fluoro-phenyl)-amine,
ZINC44480075,
AKOS011050092,
|
| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 165.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.211g/mol |
| Monoisotopic Mass | 165.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number