| CAS Number | 1369011-12-0 |
| Catalog Number | AG01B9NK |
| Chemical Name | 4-(4-tert-Butylphenyl)cyclohexan-1-amine |
| IUPAC Name | 4-(4-tert-butylphenyl)cyclohexan-1-amine |
| InChI | InChI=1S/C16H25N/c1-16(2,3)14-8-4-12(5-9-14)13-6-10-15(17)11-7-13/h4-5,8-9,13,15H,6-7,10-11,17H2,1-3H3 |
| InChI Key | MPKXFAVHGNUKNK-UHFFFAOYSA-N |
| MDL Number | MFCD21889587 |
| Molecular Formula | C16H25N |
| Molecular Weight | 231.3764 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)C2CCC(CC2)N |
| Synonyms | 4-(4-tert-butylphenyl)cyclohexan-1-amine,
1369011-12-0,
SCHEMBL8695201,
SCHEMBL9310460,
SCHEMBL9310477,
MPKXFAVHGNUKNK-CTYIDZIISA-N,
MPKXFAVHGNUKNK-OTVXOJSOSA-N,
ZINC34742386,
AKOS019068096,
cis-4-(4-tertbutylphenyl)cyclohexylamine,
trans-4-(4-tert-Butylphenyl)cyclohexylamine,
Z2065788531,
|
| Complexity | 224 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.199g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.383g/mol |
| Monoisotopic Mass | 231.199g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number