5-heptyl-4-hexyl-2,4-dihydro-3H-pyrazol-3-one (CAS 91990-66-8) — formula C16H30N2O, molecular weight 266.42; category organic chemicals.
| CAS Number | 91990-66-8 |
|---|---|
| Molecular Formula | C16H30N2O |
| Molecular Weight | 266.42 |
| LogP | 5.6 |
| Category | Organic Chemicals |
5-heptyl-4-hexyl-2,4-dihydro-3H-pyrazol-3-one is a carbon-based organic compound with CAS registry number 91990-66-8 and molecular formula C16H30N2O (molecular weight 266.42), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 91990-66-8
Its molecular formula C16H30N2O comprises 16 C, 30 H, 2 N, 1 O atoms.
Also known as: 5-heptyl-4-hexyl-2,4-dihydro-3H-pyrazol-3-one · 5-庚基-4-己基-2,4-二氢-3H-吡唑-3-酮
Category: organic chemicals
The CAS registry number of 5-heptyl-4-hexyl-2,4-dihydro-3H-pyrazol-3-one is 91990-66-8.
Molecular formula C16H30N2O, molecular weight 266.42.
It is also registered under: 5-heptyl-4-hexyl-2,4-dihydro-3H-pyrazol-3-one, 5-庚基-4-己基-2,4-二氢-3H-吡唑-3-酮.
Category: Organic Chemicals.
Independent reference data for 5-heptyl-4-hexyl-2,4-dihydro-3H-pyrazol-3-one (CAS 91990-66-8), compiled from public chemistry databases.
| CAS 号 | 91990-66-8 |
|---|---|
| PubChem CID | 3045293 |
| 分子式 | C16H30N2O |
| IUPAC 名称 | 3-heptyl-4-hexyl-1,4-dihydropyrazol-5-one |
| UNII（FDA） | NS00064356 |
| Molecular Weight | 266.42 |
|---|---|
| XLogP3 | 5.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 11 |
| Exact Mass | 266.235813585 |
| Monoisotopic Mass | 266.235813585 |
| Topological Polar Surface Area | 41.5 |
| Heavy Atom Count | 19 |
91990-66-8; 5-Heptyl-4-hexyl-2,4-dihydro-3H-pyrazol-3-one; EINECS 295-249-7; RefChem:102703; 295-249-7; 3-Heptyl-4-hexyl-1H-pyrazol-5(4H)-one; SCHEMBL10455656; DTXSID30919414; VKGWBSIXRRRLPD-UHFFFAOYSA-N; 5-Heptyl-4-hexyl-4H-pyrazol-3-ol; NS00064356
5-庚基-4-己基-2,4-二氢-3H-吡唑-3-酮 · CAS 91990-66-8 · C16H30N2O. UNII NS00064356.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.