[2-[3-(1,5-dihydro-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-ylidene)-1-propenyl]phenoxy]acetic acid (CAS 94158-17-5) — formula C21H18N2O4, molecular weight 362.4; category organic chemicals.
| CAS Number | 94158-17-5 |
|---|---|
| Molecular Formula | C21H18N2O4 |
| Molecular Weight | 362.4 |
| LogP | 3.6 |
| Category | Organic Chemicals |
[2-[3-(1,5-dihydro-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-ylidene)-1-propenyl]phenoxy]acetic acid is a carbon-based organic compound with CAS registry number 94158-17-5 and molecular formula C21H18N2O4 (molecular weight 362.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 94158-17-5
Its molecular formula C21H18N2O4 comprises 21 C, 18 H, 2 N, 4 O atoms.
Also known as: [2-[3-(1,5-dihydro-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-ylidene)-1-propenyl]phenoxy]acetic acid · [2-[3-(1,5-二氢-3-甲基-5-氧代-1-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-(1,5-dihydro-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-ylidene)-1-propenyl]phenoxy]acetic acid is 94158-17-5.
Molecular formula C21H18N2O4, molecular weight 362.4.
It is also registered under: [2-[3-(1,5-dihydro-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-ylidene)-1-propenyl]phenoxy]acetic acid, [2-[3-(1,5-二氢-3-甲基-5-氧代-1-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-(1,5-dihydro-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-ylidene)-1-propenyl]phenoxy]acetic acid (CAS 94158-17-5), compiled from public chemistry databases.
| CAS 号 | 94158-17-5 |
|---|---|
| PubChem CID | 3023796 |
| 分子式 | C21H18N2O4 |
| IUPAC 名称 | 2-[2-[3-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)prop-1-enyl]phenoxy]acetic acid |
| UNII（FDA） | NS00066443 |
| Molecular Weight | 362.4 |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 362.12665706 |
| Monoisotopic Mass | 362.12665706 |
| Topological Polar Surface Area | 79.2 |
| Heavy Atom Count | 27 |
DTXSID201113688; NS00066443; {2-[3-(3-Methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)prop-1-en-1-yl]phenoxy}acetic acid; 2-[2-[3-(1,5-Dihydro-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-ylidene)-1-propen-1-yl]phenoxy]acetic acid
[2-[3-(1,5-二氢-3-甲基-5-氧代-1-苯基-4H-吡唑-4-亚基)-1-丙烯基]苯氧基]乙酸 · CAS 94158-17-5 · C21H18N2O4. UNII NS00066443.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.