[2-[3-[3-heptyl-1,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-4-ylidene]-1-propenyl]phenoxy]acetic acid (CAS 41388-04-9) — formula C27H27Cl3N2O4, molecular weight 549.9; category organic chemicals.
| CAS Number | 41388-04-9 |
|---|---|
| Molecular Formula | C27H27Cl3N2O4 |
| Molecular Weight | 549.9 |
| LogP | 8.5 |
| Category | Organic Chemicals |
[2-[3-[3-heptyl-1,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-4-ylidene]-1-propenyl]phenoxy]acetic acid is a carbon-based organic compound with CAS registry number 41388-04-9 and molecular formula C27H27Cl3N2O4 (molecular weight 549.9), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 41388-04-9
Its molecular formula C27H27Cl3N2O4 comprises 27 C, 27 H, 3 Cl, 2 N, 4 O atoms.
Also known as: [2-[3-[3-heptyl-1,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-4-ylidene]-1-propenyl]phenoxy]acetic acid · [2-[3-[3-庚基-1,5-二氢-5-氧代-1-(2,4,6-三氯苯基)-4H-吡唑-4-亚基]-1-丙烯基]苯氧基]乙酸
Category: organic chemicals
The CAS registry number of [2-[3-[3-heptyl-1,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-4-ylidene]-1-propenyl]phenoxy]acetic acid is 41388-04-9.
Molecular formula C27H27Cl3N2O4, molecular weight 549.9.
It is also registered under: [2-[3-[3-heptyl-1,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-4-ylidene]-1-propenyl]phenoxy]acetic acid, [2-[3-[3-庚基-1,5-二氢-5-氧代-1-(2,4,6-三氯苯基)-4H-吡唑-4-亚基]-1-丙烯基]苯氧基]乙酸.
Category: Organic Chemicals.
Independent reference data for [2-[3-[3-heptyl-1,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-4-ylidene]-1-propenyl]phenoxy]acetic acid (CAS 41388-04-9), compiled from public chemistry databases.
| CAS 号 | 41388-04-9 |
|---|---|
| PubChem CID | 3016273 |
| 分子式 | C27H27Cl3N2O4 |
| IUPAC 名称 | 2-[2-[3-[3-heptyl-5-oxo-1-(2,4,6-trichlorophenyl)pyrazol-4-ylidene]prop-1-enyl]phenoxy]acetic acid |
| UNII（FDA） | NS00057175 |
| Molecular Weight | 549.9 |
|---|---|
| XLogP3 | 8.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 12 |
| Exact Mass | 548.103640 |
| Monoisotopic Mass | 548.103640 |
| Topological Polar Surface Area | 79.2 |
| Heavy Atom Count | 36 |
[2-[3-[3-庚基-1,5-二氢-5-氧代-1-(2,4,6-三氯苯基)-4H-吡唑-4-亚基]-1-丙烯基]苯氧基]乙酸 · CAS 41388-04-9 · C27H27Cl3N2O4. UNII NS00057175.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: [2-[3-[3-庚基-1,5-二氢-5-氧代-1-(2,4,6-三氯苯基)-4H-吡唑-4-亚基]-1-丙烯基]苯氧基]乙酸