| CAS Number | 36970-20-4 |
| Catalog Number | AG019X5U(AGN-PC-0WBZV5) |
| Chemical Name | [1-(4-methoxyphenyl)cyclohexyl]methanamine |
| IUPAC Name | [1-(4-methoxyphenyl)cyclohexyl]methanamine |
| InChI | InChI=1S/C14H21NO/c1-16-13-7-5-12(6-8-13)14(11-15)9-3-2-4-10-14/h5-8H,2-4,9-11,15H2,1H3 |
| InChI Key | RYTWCTSDMHVTPC-UHFFFAOYSA-N |
| MDL Number | MFCD06213100 |
| Molecular Formula | C14H21NO |
| Molecular Weight | 219.3226 |
| SMILES | COC1=CC=C(C2(CCCCC2)CN)C=C1 |
| Synonyms | C-[1-(4-Methoxy-phenyl)-cyclohexyl]-methylamine,
36970-20-4,
[1-(4-methoxyphenyl)cyclohexyl]methanamine,
(1-(4-Methoxyphenyl)cyclohexyl)methanamine,
AC1Q4A2O,
SCHEMBL11026840,
CTK7E3888,
1792AE,
SBB085484,
ZINC11833353,
AKOS000303320,
MCULE-1188040544,
NE19345,
[(4-methoxyphenyl)cyclohexyl]methylamine,
TR-055907,
EN300-54129,
Z818727348,
C14H21NO,
|
| Complexity | 203 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.162g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.328g/mol |
| Monoisotopic Mass | 219.162g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number