3-[2-[(E)-[3-(2-carboxyethyl)-5-[(4-ethenyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methylpyrrol-2-ylidene]methyl]-5-[(3-ethyl-4-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid (CAS 3947-38-4) — formula C33H40N4O6, molecular weight 588.7; category organic chemicals.
| CAS Number | 3947-38-4 |
|---|---|
| Molecular Formula | C33H40N4O6 |
| Molecular Weight | 588.7 |
| LogP | 1.5 |
| Category | Organic Chemicals |
3-[2-[(E)-[3-(2-carboxyethyl)-5-[(4-ethenyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methylpyrrol-2-ylidene]methyl]-5-[(3-ethyl-4-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid is a carbon-based organic compound with CAS registry number 3947-38-4 and molecular formula C33H40N4O6 (molecular weight 588.7), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 3947-38-4
Its molecular formula C33H40N4O6 comprises 33 C, 40 H, 4 N, 6 O atoms.
Also known as: 3-[2-[(E)-[3-(2-carboxyethyl)-5-[(4-ethenyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methylpyrrol-2-ylidene]methyl]-5-[(3-ethyl-4-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid · 3-[2-[(E)-[3-(2-羧乙基)-5-[(4-乙烯基-3-甲基-5-氧代-1,2-二氢吡咯-2-基)甲基]-4-甲基吡咯-2-亚基]甲基]-5-[(3-乙基-4-甲基-5-氧代-1,2-二氢吡咯-2-基)甲基]-4-甲基-1H-吡咯-3-基]丙酸酸
Category: organic chemicals
The CAS registry number of 3-[2-[(E)-[3-(2-carboxyethyl)-5-[(4-ethenyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methylpyrrol-2-ylidene]methyl]-5-[(3-ethyl-4-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid is 3947-38-4.
Molecular formula C33H40N4O6, molecular weight 588.7.
It is also registered under: 3-[2-[(E)-[3-(2-carboxyethyl)-5-[(4-ethenyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methylpyrrol-2-ylidene]methyl]-5-[(3-ethyl-4-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid, 3-[2-[(E)-[3-(2-羧乙基)-5-[(4-乙烯基-3-甲基-5-氧代-1,2-二氢吡咯-2-基)甲基]-4-甲基吡咯-2-亚基]甲基]-5-[(3-乙基-4-甲基-5-氧代-1,2-二氢吡咯-2-基)甲基]-4-甲基-1H-吡咯-3-基]丙酸酸.
Category: Organic Chemicals.
Independent reference data for 3-[2-[(E)-[3-(2-carboxyethyl)-5-[(4-ethenyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methylpyrrol-2-ylidene]methyl]-5-[(3-ethyl-4-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid (CAS 3947-38-4), compiled from public chemistry databases.
| CAS 号 | 3947-38-4 |
|---|---|
| PubChem CID | 440786 |
| 分子式 | C33H40N4O6 |
| IUPAC 名称 | 3-[2-[[3-(2-carboxyethyl)-5-[(3-ethyl-4-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-2-yl]methylidene]-5-[(4-ethenyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methylpyrrol-3-yl]propanoic acid |
| Molecular Weight | 588.7 |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 13 |
| Exact Mass | 588.29478501 |
| Monoisotopic Mass | 588.29478501 |
| Topological Polar Surface Area | 161 |
| Heavy Atom Count | 43 |
3947-38-4; SCHEMBL21594808; DTXSID80331526
3-[2-[(E)-[3-(2-羧乙基)-5-[(4-乙烯基-3-甲基-5-氧代-1,2-二氢吡咯-2-基)甲基]-4-甲基吡咯-2-亚基]甲基]-5-[(3-乙基-4-甲基-5-氧代-1,2-二氢吡咯-2-基)甲基]-4-甲基-1H-吡咯-3-基]丙酸酸 · CAS 3947-38-4 · C33H40N4O6.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.