Benzonitrile, 4-[5-(trans-4-heptylcyclohexyl)-2-pyrimidinyl]-
4-[5-(4-heptylcyclohexyl)pyrimidin-2-yl]benzonitrile
Also Known As: ACMC-1BGC6|Benzonitrile, 4-[5-(trans-4-heptylcyclohexyl)-2-pyrimidinyl]-|Benzonitrile, 4-[5-(4-heptylcyclohexyl)-2-pyrimidinyl]-|4-[5-(4-Heptylcyclohexyl)-2-pyrimidinyl]benzonitrile|4-[5-(4-heptylcyclohexyl)pyrimidin-2-yl]benzonitrile|trans-4-(5-(4-Heptylcyclohexyl)-2-pyrimidinyl)benzonitrile|4-{5-[(1s,4r)-4-heptylcyclohexyl]pyrimidin-2-yl}benzonitrile|Benzonitrile, 4-(5-(trans-4-heptylcyclohexyl)-2-pyrimidinyl)-|TRANS-4-[5-(4-HEPTYLCYCLOHEXYL)-2-PYRIMIDYL]BENZONITRILE|4-[5-(4-Heptyl-cyclohexyl)-pyrimidin-2-yl]-benzonitrile|trans-4-(5-(4-Heptylcyclohexyl)-2-pyrimidyl)benzonitrile|Benzonitrile,4-[5-(trans-4-heptylcyclohexyl)-2-pyrimidinyl]-|4-[5-(4alpha-Heptylcyclohexan-1beta-yl)-2-pyrimidinyl]benzonitrile|4-[5-(4beta-Heptylcyclohexan-1alpha-yl)pyrimidin-2-yl]benzonitrile|Benzonitrile, 4-[5-(4-heptylcyclohexyl)-2-pyrimidinyl]-, trans-
| Molecular Formula | C24H31N3 |
|---|---|
| Molecular Weight | 361.2518 g/mol |
| LogP | 7.6 |
| Topological Polar Surface Area | 49.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 361.2518 |
| Monoisotopic Mass | 361.2518 |
| Heavy Atoms | 27 |
| Complexity | 443.0 |
Chemical Identifiers
| CAS Number | 116265-98-6 |
|---|---|
| SMILES | CCCCCCCC1CCC(CC1)C2=CN=C(N=C2)C3=CC=C(C=C3)C#N |
| InChIKey | VJMNQADPCKONIA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzonitrile, 4-[5-(trans-4-heptylcyclohexyl)-2-pyrimidinyl]- (CAS 116265-98-6), with molecular formula C24H31N3 and molecular weight 361.2518 g/mol. IUPAC: 4-[5-(4-heptylcyclohexyl)pyrimidin-2-yl]benzonitrile.
Benzonitrile, 4-[5-(trans-4-heptylcyclohexyl)-2-pyrimidinyl]- is a custom synthesis product. We offer services from milligram to kilogram scale.
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