| CAS Number | 801212-34-0 |
| Catalog Number | AG01AGQK(AGN-PC-0WO25J) |
| Chemical Name | (4-Phenylcyclohexyl)methanamine |
| IUPAC Name | (4-phenylcyclohexyl)methanamine |
| InChI | InChI=1S/C13H19N/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-5,11,13H,6-10,14H2 |
| InChI Key | CULUUPJKELOFHD-UHFFFAOYSA-N |
| MDL Number | MFCD11641533 |
| Molecular Formula | C13H19N |
| Molecular Weight | 189.2967 |
| SMILES | C1(=CC=CC=C1)C1CCC(CC1)CN |
| Synonyms | (4-phenylcyclohexyl)methanamine,
801212-34-0,
AC1Q546E,
SCHEMBL8694293,
SCHEMBL17730052,
SCHEMBL17752200,
CULUUPJKELOFHD-BJHJDKERSA-N,
Cis-(4-phenylcyclohexyl)methanamine,
ZINC37245887,
AKOS008129062,
NE39165,
EN300-72566,
|
| Complexity | 153 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.302g/mol |
| Monoisotopic Mass | 189.152g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number