| CAS Number | 351894-04-7 |
| Catalog Number | AG007FJA(AGN-PC-0WB4DH) |
| Chemical Name | (2E)-2-Cyano-N-cyclohexyl-3-(4-hydroxyphenyl)acrylamide |
| IUPAC Name | 2-cyano-N-cyclohexyl-3-(4-hydroxyphenyl)prop-2-enamide |
| InChI | InChI=1S/C16H18N2O2/c17-11-13(10-12-6-8-15(19)9-7-12)16(20)18-14-4-2-1-3-5-14/h6-10,14,19H,1-5H2,(H,18,20) |
| InChI Key | DUPVLVSNYMMWHR-UHFFFAOYSA-N |
| MDL Number | MFCD01801084 |
| Molecular Formula | C16H18N2O2 |
| Molecular Weight | 270.3263 |
| SMILES | C(/C#N)(=C/C1=CC=C(C=C1)O)C(=O)NC1CCCCC1 |
| Synonyms | 351894-04-7,
AC1MFH7P,
(2E)-2-CYANO-N-CYCLOHEXYL-3-(4-HYDROXYPHENYL)ACRYLAMIDE,
(E)-2-Cyano-N-cyclohexyl-3-(4-hydroxyphenyl)acrylamide,
CTK4H3855,
DTXSID50386760,
AKOS030253902,
MCULE-7969894616,
2-cyano-N-cyclohexyl-3-(4-hydroxyphenyl)prop-2-enamide,
CHEMBRDG-BB 5831960,
ZINC00442122,
CID2871665,
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| Complexity | 407 |
| 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
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Certificate of Analysis
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