| CAS Number | 3158-69-8 |
| Catalog Number | AG01ACUS(AGN-PC-0AM27L) |
| Chemical Name | 4-Cyclobutylaniline |
| IUPAC Name | 4-cyclobutylaniline |
| InChI | InChI=1S/C10H13N/c11-10-6-4-9(5-7-10)8-2-1-3-8/h4-8H,1-3,11H2 |
| InChI Key | STQVTMCLQCBATO-UHFFFAOYSA-N |
| MDL Number | MFCD19203872 |
| Molecular Formula | C10H13N |
| Molecular Weight | 147.2169 |
| SMILES | NC1=CC=C(C2CCC2)C=C1 |
| Synonyms | 4-cyclobutylaniline,
3158-69-8,
SCHEMBL3484987,
ZINC72193142,
AKOS006339585,
NE33235,
F8887-6868,
Z1895554498,
|
| Complexity | 121 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 147.105g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 147.221g/mol |
| Monoisotopic Mass | 147.105g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number