| CAS Number | 1250770-52-5 |
| Catalog Number | AG01AIFV(AGN-PC-0WO266) |
| Chemical Name | 2-Cyclohexyl-1-(pyrimidin-2-yl)ethan-1-amine |
| IUPAC Name | 2-cyclohexyl-1-pyrimidin-2-ylethanamine |
| InChI | InChI=1S/C12H19N3/c13-11(12-14-7-4-8-15-12)9-10-5-2-1-3-6-10/h4,7-8,10-11H,1-3,5-6,9,13H2 |
| InChI Key | QMDNROCGZJLYHP-UHFFFAOYSA-N |
| MDL Number | MFCD16822528 |
| Molecular Formula | C12H19N3 |
| Molecular Weight | 205.2994 |
| SMILES | C1(CCCCC1)CC(N)C1=NC=CC=N1 |
| Synonyms | 2-cyclohexyl-1-(pyrimidin-2-yl)ethan-1-amine,
1250770-52-5,
AKOS011892424,
NE55804,
EN300-77692,
|
| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.305g/mol |
| Monoisotopic Mass | 205.158g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number