| CAS Number | 1340433-68-2 |
| Catalog Number | AG019TXP(AGN-PC-0WO3EU) |
| Chemical Name | 3-(ethylsulfanyl)cyclohexan-1-amine |
| IUPAC Name | 3-ethylsulfanylcyclohexan-1-amine |
| InChI | InChI=1S/C8H17NS/c1-2-10-8-5-3-4-7(9)6-8/h7-8H,2-6,9H2,1H3 |
| InChI Key | VOKGEDJHMODUIZ-UHFFFAOYSA-N |
| MDL Number | MFCD20402579 |
| Molecular Formula | C8H17NS |
| Molecular Weight | 159.2923 |
| SMILES | CCSC1CC(N)CCC1 |
| Synonyms | 3-(ethylsulfanyl)cyclohexan-1-amine,
1340433-68-2,
SCHEMBL14959702,
AKOS014045906,
MCULE-7521699492,
NE17854,
Z1340493792,
|
| Complexity | 95.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 159.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 159.291g/mol |
| Monoisotopic Mass | 159.108g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 51.3A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number