4-Benzoyl-4-(2-cyanoethyl)heptanedinitrile
4-benzoyl-4-(2-cyanoethyl)heptanedinitrile
Also Known As: 4-benzoyl-4-(2-cyanoethyl)heptanedinitrile|Tris(cyanoethyl)acetophenone|Phenacylidynetripropionitrile|Propionitrile, phenacylidynetri-|AI3-16027|ZERO/000208|Heptanedinitrile, 4-benzoyl-4-(2-cyanoethyl)-|3-10-00-04131 (Beilstein Handbook Reference)|BAS 00390214|2,2,2-TRIS(2-CYANOETHYL)ACETOPHENONE|4-benzoyl-4(2-cyanoethyl)heptanedinitrile|Heptanedinitrile, 4-benzoyl-4-(2-cyanoethyl)- (6CI,9CI)|4-Benzoyl-4-(2-cyano-ethyl)-heptanedinitrile|4-(2-cyanoethyl)-4-(phenylcarbonyl)heptanedinitrile|PROPIONITRILE, 3,3',3''-PHENACYLIDYNETRI-|alpha,alpha,alpha-Tris(2-cyanoethyl)acetophenone|Heptanedinitrile, 4-benzoyl-4- (2-cyanoethyl)-
| Molecular Formula | C17H17N3O |
|---|---|
| Molecular Weight | 279.13718 g/mol |
| LogP | 3.77 |
| Topological Polar Surface Area | 88.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 279.13718 |
| Heavy Atoms | 21 |
| Complexity | 541.6 |
Chemical Identifiers
| CAS Number | 5342-96-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C(CCC#N)(CCC#N)CCC#N |
Product Overview
4-Benzoyl-4-(2-cyanoethyl)heptanedinitrile (CAS 5342-96-1), with molecular formula C17H17N3O and molecular weight 279.13718 g/mol. IUPAC: 4-benzoyl-4-(2-cyanoethyl)heptanedinitrile.
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