| CAS Number | 351893-99-7 |
| Catalog Number | AG00C62W(AGN-PC-0WB4DF) |
| Chemical Name | (E)-2-Cyano-N-cyclohexyl-3-(3-hydroxyphenyl)acrylamide |
| IUPAC Name | 2-cyano-N-cyclohexyl-3-(3-hydroxyphenyl)prop-2-enamide |
| InChI | InChI=1S/C16H18N2O2/c17-11-13(9-12-5-4-8-15(19)10-12)16(20)18-14-6-2-1-3-7-14/h4-5,8-10,14,19H,1-3,6-7H2,(H,18,20) |
| InChI Key | KQZVZLBNHAPQHA-UHFFFAOYSA-N |
| MDL Number | MFCD01801073 |
| Molecular Formula | C16H18N2O2 |
| Molecular Weight | 270.3263 |
| SMILES | C(/C#N)(=C/C1=CC=CC(O)=C1)C(=O)NC1CCCCC1 |
| Synonyms | AC1MFGVJ,
351893-99-7,
CHEMBRDG-BB 5827664,
(2E)-2-CYANO-N-CYCLOHEXYL-3-(3-HYDROXYPHENYL)ACRYLAMIDE,
CTK4H3854,
DTXSID60386756,
AKOS030253901,
MCULE-1389265187,
(E)-2-Cyano-N-cyclohexyl-3-(3-hydroxyphenyl)acrylamide,
2-cyano-N-cyclohexyl-3-(3-hydroxyphenyl)prop-2-enamide,
ZINC00442080,
CID2871518,
|
| Complexity | 415 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 270.137g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.332g/mol |
| Monoisotopic Mass | 270.137g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 73.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number