4-[4-(3-Sulfoanilino)-6-chloro-1,3,5-triazine-2-ylamino]-5-hydroxy-6-[4-[2-(sulfooxy)ethylsulfonyl]phenylazo]-2,7-naphthalenedisulfonic acid (CAS 72987-39-4) — formula C27H22ClN7O16S5, molecular weight 896.3; category organic chemicals.
| CAS Number | 72987-39-4 |
|---|---|
| Molecular Formula | C27H22ClN7O16S5 |
| Molecular Weight | 896.3 |
| LogP | 2.3 |
| Applications | General Manufacturing Information: 2, 7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-[(3-sulfophenyl)amino]-1, 3, 5-triazin-2-yl]amino]-4-hydroxy-3-[2-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-: ACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: 2, 7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-[(3-sulfophenyl)amino]-1, 3, 5-triazin-2-yl]amino]-4-hydroxy-3-[2-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-: ACTIVE.
4-[4-(3-Sulfoanilino)-6-chloro-1,3,5-triazine-2-ylamino]-5-hydroxy-6-[4-[2-(sulfooxy)ethylsulfonyl]phenylazo]-2,7-naphthalenedisulfonic acid is a carbon-based organic compound with CAS registry number 72987-39-4 and molecular formula C27H22ClN7O16S5 (molecular weight 896.3), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 72987-39-4
Its molecular formula C27H22ClN7O16S5 comprises 27 C, 22 H, 1 Cl, 7 N, 16 O, 5 S atoms.
Also known as: 4-[4-(3-Sulfoanilino)-6-chloro-1,3,5-triazine-2-ylamino]-5-hydroxy-6-[4-[2-(sulfooxy)ethylsulfonyl]phenylazo]-2,7-naphthalenedisulfonic acid · 4-[4-(3-磺苯胺基)-6-氯-1,3,5-三嗪-2-基氨基]-5-羟基-6-[4-[2-(磺氧基)乙基磺酰基]苯基偶氮]-2,7-萘二磺酸
Category: organic chemicals
The CAS registry number of 4-[4-(3-Sulfoanilino)-6-chloro-1,3,5-triazine-2-ylamino]-5-hydroxy-6-[4-[2-(sulfooxy)ethylsulfonyl]phenylazo]-2,7-naphthalenedisulfonic acid is 72987-39-4.
Molecular formula C27H22ClN7O16S5, molecular weight 896.3.
It is also registered under: 4-[4-(3-Sulfoanilino)-6-chloro-1,3,5-triazine-2-ylamino]-5-hydroxy-6-[4-[2-(sulfooxy)ethylsulfonyl]phenylazo]-2,7-naphthalenedisulfonic acid, 4-[4-(3-磺苯胺基)-6-氯-1,3,5-三嗪-2-基氨基]-5-羟基-6-[4-[2-(磺氧基)乙基磺酰基]苯基偶氮]-2,7-萘二磺酸.
Recorded applications: General Manufacturing Information: 2, 7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-[(3-sulfophenyl)amino]-1, 3, 5-triazin-2-yl]amino]-4-hydroxy-3-[2-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-: ACTIVE.
Category: Organic Chemicals.
Independent reference data for 4-[4-(3-Sulfoanilino)-6-chloro-1,3,5-triazine-2-ylamino]-5-hydroxy-6-[4-[2-(sulfooxy)ethylsulfonyl]phenylazo]-2,7-naphthalenedisulfonic acid (CAS 72987-39-4), compiled from public chemistry databases.
| CAS 号 | 72987-39-4 |
|---|---|
| PubChem CID | 166508 |
| 分子式 | C27H22ClN7O16S5 |
| IUPAC 名称 | 5-[[4-chloro-6-(3-sulfoanilino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[[4-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2,7-disulfonic acid |
| UNII（FDA） | NS00040863 |
| Molecular Weight | 896.3 |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 7 |
| Hydrogen Bond Acceptor Count | 23 |
| Rotatable Bond Count | 14 |
| Exact Mass | 894.9415112 |
| Monoisotopic Mass | 894.9415112 |
| Topological Polar Surface Area | 410 |
| Heavy Atom Count | 56 |
72987-39-4; RefChem:299125; SCHEMBL3699268; DTXSID0072699; SCHEMBL13880678; SCHEMBL30950828; JZWSGEZNRDXUIX-UHFFFAOYSA-N; NS00040863
4-[4-(3-磺苯胺基)-6-氯-1,3,5-三嗪-2-基氨基]-5-羟基-6-[4-[2-(磺氧基)乙基磺酰基]苯基偶氮]-2,7-萘二磺酸 · CAS 72987-39-4 · C27H22ClN7O16S5. UNII NS00040863.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-[4-(3-磺苯胺基)-6-氯-1,3,5-三嗪-2-基氨基]-5-羟基-6-[4-[2-(磺氧基)乙基磺酰基]苯基偶氮]-2,7-萘二磺酸