N-(2-chloroethyl)-3-[ethyl[4-[(5-nitro-2,1-benzisothiazol-3-yl)azo]phenyl]amino]propionamide (CAS 84100-07-2) — formula C20H21ClN6O3S, molecular weight 460.9; category organic chemicals.
| CAS Number | 84100-07-2 |
|---|---|
| Molecular Formula | C20H21ClN6O3S |
| Molecular Weight | 460.9 |
| LogP | 4.6 |
| Category | Organic Chemicals |
N-(2-chloroethyl)-3-[ethyl[4-[(5-nitro-2,1-benzisothiazol-3-yl)azo]phenyl]amino]propionamide is a carbon-based organic compound with CAS registry number 84100-07-2 and molecular formula C20H21ClN6O3S (molecular weight 460.9), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 84100-07-2
Its molecular formula C20H21ClN6O3S comprises 20 C, 21 H, 1 Cl, 6 N, 3 O, 1 S atoms.
Also known as: N-(2-chloroethyl)-3-[ethyl[4-[(5-nitro-2,1-benzisothiazol-3-yl)azo]phenyl]amino]propionamide · N-(2-氯乙基)-3-[乙基[4-[(5-硝基-2,1-苯并异噻唑-3-基)偶氮]苯基]氨基]丙酰胺
Category: organic chemicals
The CAS registry number of N-(2-chloroethyl)-3-[ethyl[4-[(5-nitro-2,1-benzisothiazol-3-yl)azo]phenyl]amino]propionamide is 84100-07-2.
Molecular formula C20H21ClN6O3S, molecular weight 460.9.
It is also registered under: N-(2-chloroethyl)-3-[ethyl[4-[(5-nitro-2,1-benzisothiazol-3-yl)azo]phenyl]amino]propionamide, N-(2-氯乙基)-3-[乙基[4-[(5-硝基-2,1-苯并异噻唑-3-基)偶氮]苯基]氨基]丙酰胺.
Category: Organic Chemicals.
Independent reference data for N-(2-chloroethyl)-3-[ethyl[4-[(5-nitro-2,1-benzisothiazol-3-yl)azo]phenyl]amino]propionamide (CAS 84100-07-2), compiled from public chemistry databases.
| CAS 号 | 84100-07-2 |
|---|---|
| PubChem CID | 16205447 |
| 分子式 | C20H21ClN6O3S |
| IUPAC 名称 | N-(2-chloroethyl)-3-[N-ethyl-4-[(5-nitro-2,1-benzothiazol-3-yl)diazenyl]anilino]propanamide |
| UNII（FDA） | N5YVD6B7ZL |
| Molecular Weight | 460.9 |
|---|---|
| XLogP3 | 4.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 9 |
| Exact Mass | 460.1084374 |
| Monoisotopic Mass | 460.1084374 |
| Topological Polar Surface Area | 144 |
| Heavy Atom Count | 31 |
84100-07-2; EINECS 282-088-2; N-(2-CHLOROETHYL)-3-[ETHYL[4-[(5-NITRO-2,1-BENZISOTHIAZOL-3-YL)AZO]PHENYL]AMINO]PROPIONAMIDE; N-(2-Chloroethyl)-3-(ethyl(4-((5-nitro-2,1-benzisothiazol-3-yl)azo)phenyl)amino)propionamide; N-(2-Chloroethyl)-3-[ethyl[4-[2-(5-nitro-2,1-benzisothiazol-3-yl)diazenyl]phenyl]amino]propanamide; N5YVD6B7ZL; UDSMBLVBRYEGJY-UHFFFAOYSA-N; DTXSID901115211; NS00058204; N-(2-Chloroethyl)-N~3~-ethyl-N~3~-{4-[(5-nitro-2,1-benzothiazol-3-yl)diazenyl]phenyl}-beta-alaninamide; Propanamide, N-(2-chloroethyl)-3-[ethyl[4-[(5-nitro-2,1-benzisothiazol-3-yl)azo]phenyl]amino]-; Propanamide, N-(2-chloroethyl)-3-[ethyl[4-[2-(5-nitro-2,1-benzisothiazol-3-yl)diazenyl]phenyl]amino]-
N-(2-氯乙基)-3-[乙基[4-[(5-硝基-2,1-苯并异噻唑-3-基)偶氮]苯基]氨基]丙酰胺 · CAS 84100-07-2 · C20H21ClN6O3S. UNII N5YVD6B7ZL.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.