5-[[1,3-dioxo-3-[4-[(1-oxohexadecyl)amino]phenyl]propyl]amino]isophthalic acid (CAS 94386-43-3) — formula C33H44N2O7, molecular weight 580.7; category organic chemicals.
| CAS Number | 94386-43-3 |
|---|---|
| Molecular Formula | C33H44N2O7 |
| Molecular Weight | 580.7 |
| LogP | 8.7 |
| Category | Organic Chemicals |
5-[[1,3-dioxo-3-[4-[(1-oxohexadecyl)amino]phenyl]propyl]amino]isophthalic acid is a carbon-based organic compound with CAS registry number 94386-43-3 and molecular formula C33H44N2O7 (molecular weight 580.7), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 94386-43-3
Its molecular formula C33H44N2O7 comprises 33 C, 44 H, 2 N, 7 O atoms.
Also known as: 5-[[1,3-dioxo-3-[4-[(1-oxohexadecyl)amino]phenyl]propyl]amino]isophthalic acid · 5-[[1,3-二氧代-3-[4-[(1-氧代十六烷基)氨基]苯基]丙基]氨基]间苯二甲酸
Category: organic chemicals
The CAS registry number of 5-[[1,3-dioxo-3-[4-[(1-oxohexadecyl)amino]phenyl]propyl]amino]isophthalic acid is 94386-43-3.
Molecular formula C33H44N2O7, molecular weight 580.7.
It is also registered under: 5-[[1,3-dioxo-3-[4-[(1-oxohexadecyl)amino]phenyl]propyl]amino]isophthalic acid, 5-[[1,3-二氧代-3-[4-[(1-氧代十六烷基)氨基]苯基]丙基]氨基]间苯二甲酸.
Category: Organic Chemicals.
Independent reference data for 5-[[1,3-dioxo-3-[4-[(1-oxohexadecyl)amino]phenyl]propyl]amino]isophthalic acid (CAS 94386-43-3), compiled from public chemistry databases.
| CAS 号 | 94386-43-3 |
|---|---|
| PubChem CID | 216430 |
| 分子式 | C33H44N2O7 |
| IUPAC 名称 | 5-[[3-[4-(hexadecanoylamino)phenyl]-3-oxopropanoyl]amino]benzene-1,3-dicarboxylic acid |
| UNII（FDA） | NS00040396 |
| Molecular Weight | 580.7 |
|---|---|
| XLogP3 | 8.7 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 21 |
| Exact Mass | 580.31485175 |
| Monoisotopic Mass | 580.31485175 |
| Topological Polar Surface Area | 150 |
| Heavy Atom Count | 42 |
94386-43-3; 5-((1,3-Dioxo-3-(4-((1-oxohexadecyl)amino)phenyl)propyl)amino)isophthalic acid; 5-[[1,3-DIOXO-3-[4-[(1-OXOHEXADECYL)AMINO]PHENYL]PROPYL]AMINO]ISOPHTHALIC ACID; EINECS 305-265-9; DTXSID40241455; AZOTVGZNUKURSS-UHFFFAOYSA-N; 5-[3-(4-HEXADECANAMIDOPHENYL)-3-OXOPROPANAMIDO]BENZENE-1,3-DICARBOXYLIC ACID; NS00040396
5-[[1,3-二氧代-3-[4-[(1-氧代十六烷基)氨基]苯基]丙基]氨基]间苯二甲酸 · CAS 94386-43-3 · C33H44N2O7. UNII NS00040396.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.