trans-4-[5-(4-ethylcyclohexyl)-2-pyrimidyl]benzonitrile (CAS 72785-11-6) — formula C19H21N3, molecular weight 291.4; category organic chemicals.
| CAS Number | 72785-11-6 |
|---|---|
| Molecular Formula | C19H21N3 |
| Molecular Weight | 291.4 |
| LogP | 4.9 |
| Applications | General Manufacturing Information: Benzonitrile, 4-[5-(trans-4-ethylcyclohexyl)-2-pyrimidinyl]-: ACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: Benzonitrile, 4-[5-(trans-4-ethylcyclohexyl)-2-pyrimidinyl]-: ACTIVE.
trans-4-[5-(4-ethylcyclohexyl)-2-pyrimidyl]benzonitrile is a carbon-based organic compound with CAS registry number 72785-11-6 and molecular formula C19H21N3 (molecular weight 291.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 72785-11-6
Its molecular formula C19H21N3 comprises 19 C, 21 H, 3 N atoms.
Also known as: trans-4-[5-(4-ethylcyclohexyl)-2-pyrimidyl]benzonitrile · 反-4-[5-(4-乙基环己基)-2-嘧啶基]苯甲腈
Category: organic chemicals
The CAS registry number of trans-4-[5-(4-ethylcyclohexyl)-2-pyrimidyl]benzonitrile is 72785-11-6.
Molecular formula C19H21N3, molecular weight 291.4.
It is also registered under: trans-4-[5-(4-ethylcyclohexyl)-2-pyrimidyl]benzonitrile, 反-4-[5-(4-乙基环己基)-2-嘧啶基]苯甲腈.
Recorded applications: General Manufacturing Information: Benzonitrile, 4-[5-(trans-4-ethylcyclohexyl)-2-pyrimidinyl]-: ACTIVE.
Category: Organic Chemicals.
Independent reference data for trans-4-[5-(4-ethylcyclohexyl)-2-pyrimidyl]benzonitrile (CAS 72785-11-6), compiled from public chemistry databases.
| CAS 号 | 72785-11-6 |
|---|---|
| PubChem CID | 175154 |
| 分子式 | C19H21N3 |
| IUPAC 名称 | 4-[5-(4-ethylcyclohexyl)pyrimidin-2-yl]benzonitrile |
| UNII（FDA） | NS00126823 |
| Molecular Weight | 291.4 |
|---|---|
| XLogP3 | 4.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 291.173547683 |
| Monoisotopic Mass | 291.173547683 |
| Topological Polar Surface Area | 49.6 |
| Heavy Atom Count | 22 |
72785-11-6; Benzonitrile, 4-[5-(trans-4-ethylcyclohexyl)-2-pyrimidinyl]-; Benzonitrile, 4-(5-(trans-4-ethylcyclohexyl)-2-pyrimidinyl)-; EINECS 276-833-0; 4-(5-((1r,4r)-4-ethylcyclohexyl)pyrimidin-2-yl)benzonitrile; 4-{5-[(1r,4r)-4-Ethylcyclohexyl]pyrimidin-2-yl}benzonitrile; SCHEMBL9059529; SCHEMBL10457384; DTXSID30888191; trans-4-(5-(4-Ethylcyclohexyl)-2-pyrimidinyl)benzonitrile; YAZXDRDFNUEKBH-UHFFFAOYSA-N; NS00126823; trans-4-(5-(4-Ethylcyclohexyl)-2-pyrimidyl)benzonitrile; 5-(trans-4-ethylcyclohexyl)-2-(4-cyanophenyl)-pyrimidine
反-4-[5-(4-乙基环己基)-2-嘧啶基]苯甲腈 · CAS 72785-11-6 · C19H21N3. UNII NS00126823.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.