| CAS Number | 1157398-35-0 |
| Catalog Number | AG01BTES |
| Chemical Name | 2-Amino-4-cyclohexylthiophene-3-carbonitrile |
| IUPAC Name | 2-amino-4-cyclohexylthiophene-3-carbonitrile |
| InChI | InChI=1S/C11H14N2S/c12-6-9-10(7-14-11(9)13)8-4-2-1-3-5-8/h7-8H,1-5,13H2 |
| InChI Key | NULLHHGMHCJSJQ-UHFFFAOYSA-N |
| MDL Number | MFCD12065522 |
| Molecular Formula | C11H14N2S |
| Molecular Weight | 206.3073 |
| SMILES | NC1=C(C#N)C(C2CCCCC2)=CS1 |
| Synonyms | 2-amino-4-cyclohexylthiophene-3-carbonitrile,
1157398-35-0,
ZINC37366955,
AKOS009989966,
|
| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 206.088g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.307g/mol |
| Monoisotopic Mass | 206.088g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 78A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number