| CAS Number | 170303-48-7 |
| Catalog Number | AG01B067(AGN-PC-0WOE8F) |
| Chemical Name | N-cyclobutyl-4-methylaniline |
| IUPAC Name | N-cyclobutyl-4-methylaniline |
| InChI | InChI=1S/C11H15N/c1-9-5-7-11(8-6-9)12-10-3-2-4-10/h5-8,10,12H,2-4H2,1H3 |
| InChI Key | ASXGIRGREJQHOS-UHFFFAOYSA-N |
| MDL Number | MFCD16107991 |
| Molecular Formula | C11H15N |
| Molecular Weight | 161.2435 |
| SMILES | CC1=CC=C(NC2CCC2)C=C1 |
| Synonyms | N-cyclobutyl-4-methylaniline,
170303-48-7,
SCHEMBL7794525,
ZINC44480164,
AKOS011050710,
|
| Complexity | 132 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 161.12g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 161.248g/mol |
| Monoisotopic Mass | 161.12g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number