| CAS Number | 1178766-30-7 |
| Catalog Number | AG01A9W1 |
| Chemical Name | 2-(4-chlorophenyl)-1-cyclohexylethan-1-amine |
| IUPAC Name | 2-(4-chlorophenyl)-1-cyclohexylethanamine |
| InChI | InChI=1S/C14H20ClN/c15-13-8-6-11(7-9-13)10-14(16)12-4-2-1-3-5-12/h6-9,12,14H,1-5,10,16H2 |
| InChI Key | HPQHKFRYWGPIRF-UHFFFAOYSA-N |
| MDL Number | MFCD11919341 |
| Molecular Formula | C14H20ClN |
| Molecular Weight | 237.7683 |
| SMILES | NC(C1CCCCC1)CC1=CC=C(Cl)C=C1 |
| Synonyms | 2-(4-chlorophenyl)-1-cyclohexylethan-1-amine,
1178766-30-7,
AC1Q5098,
AKOS010038599,
MCULE-2008701211,
NE25721,
EN300-66336,
Z1263529774,
|
| Complexity | 193 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.128g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.771g/mol |
| Monoisotopic Mass | 237.128g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.3 |
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Certificate of Analysis
Lot Number