| CAS Number | 1235440-78-4 |
| Catalog Number | AG01A8ET |
| Chemical Name | [1-(4-tert-Butylphenyl)cyclobutyl]methanamine hydrochloride |
| IUPAC Name | [1-(4-tert-butylphenyl)cyclobutyl]methanamine;hydrochloride |
| InChI | InChI=1S/C15H23N.ClH/c1-14(2,3)12-5-7-13(8-6-12)15(11-16)9-4-10-15;/h5-8H,4,9-11,16H2,1-3H3;1H |
| InChI Key | MLMMGFSNSZJJMS-UHFFFAOYSA-N |
| MDL Number | MFCD16040024 |
| Molecular Formula | C15H24ClN |
| Molecular Weight | 253.8108 |
| SMILES | Cl.CC(C1=CC=C(C2(CCC2)CN)C=C1)(C)C |
| Synonyms | [1-(4-tert-butylphenyl)cyclobutyl]methanamine hydrochloride,
1235440-78-4,
1-[4-(tert-Butyl)phenyl]cyclobutanemethanamine Hydrochloride,
AC1Q38YQ,
MCULE-3525703970,
NE19656,
SY183519,
EN300-61456,
MFCD16040024 (95%),
Z992717162,
|
| Complexity | 226 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 253.16g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.814g/mol |
| Monoisotopic Mass | 253.16g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number