| CAS Number | 76253-28-6 |
| Catalog Number | AG01A89R(AGN-PC-0NKNMB) |
| Chemical Name | 4-(Cyclohexylmethoxy)aniline |
| IUPAC Name | 4-(cyclohexylmethoxy)aniline |
| InChI | InChI=1S/C13H19NO/c14-12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11/h6-9,11H,1-5,10,14H2 |
| InChI Key | DRHKVTPDSILGSR-UHFFFAOYSA-N |
| MDL Number | MFCD08687495 |
| Molecular Formula | C13H19NO |
| Molecular Weight | 205.2961 |
| SMILES | NC1=CC=C(OCC2CCCCC2)C=C1 |
| Synonyms | 4-(cyclohexylmethoxy)aniline,
76253-28-6,
4-cyclohexylmethoxy-aniline,
4-(cyclohexylmethyloxy)aniline,
4-cyclohexylmethoxy-phenylamine,
AC1Q525F,
SCHEMBL2657957,
DRHKVTPDSILGSR-UHFFFAOYSA-N,
ZINC14630109,
AKOS000198563,
MCULE-6508086635,
NE20620,
TR-046575,
EN300-61116,
Z1262250839,
N/A,
|
| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.301g/mol |
| Monoisotopic Mass | 205.147g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number