Sodium 2-[(1E,3E)-6-hydroxy-3-{2-[(2E)-1,3,3-trimethyl-5-sulfonato-2,3-dihydro-1H-indol-2-ylidene]ethylidene}hex-1-en-1-yl]-1,3,3-trimethyl-3H-indol-1-ium-5-sulfonate
Structure Info
- Chemspace ID
- CSSB03437230330 (In-Stock Building Blocks)
- CAS
- 952313-31-4
- MFCD
- MFCD06409867
- IUPAC Name
- sodium 2-[(1E,3E)-6-hydroxy-3-{2-[(2E)-1,3,3-trimethyl-5-sulfonato-2,3-dihydro-1H-indol-2-ylidene]ethylidene}hex-1-en-1-yl]-1,3,3-trimethyl-3H-indol-1-ium-5-sulfonate
- Mol formula
- C30H35N2NaO7S2
- Mol weight
- 623 Da
- Catalog Number(s)
- 138986, BBLS03437230330, EN300-24771033, bbls03437230330
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.54
- Heavy atoms count
- 42
- Rotatable bond count
- 8
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.366
- Polar surface area (Å)
- 141
- Hydrogen bond acceptors count
- 8
- Hydrogen bond donors count
- 1
![Chemical structure of Sodium 2-[(1E,3E)-6-hydroxy-3-{2-[(2E)-1,3,3-trimethyl-5-sulfonato-2,3-dihydro-1H-indol-2-ylidene]ethylidene}hex-1-en-1-yl]-1,3,3-trimethyl-3H-indol-1-ium-5-sulfonate (C30H35N2NaO7S2) - CSSB03437230330](/st/structure/200/5bc092eb023b4da73ec9a10029e6fd88/%255BNa%252B%255D.CN1C2%253DC%2528C%253DC%2528C%253DC2%2529S%2528%255BO-%255D%2529%2528%253DO%2529%253DO%2529C%2528C%2529%2528C%2529%255CC1%253DC%252FC%253DC%2528%255CCCCO%2529%252FC%253DC%252FC1%253D%255BN%252B%255D%2528C%2529C2%253DC%2528C%253DC%2528C%253DC2%2529S%2528%255BO-%255D%2529%2528%253DO%2529%253DO%2529C1%2528C%2529C.png "C30H35N2NaO7S2")
- Zoom the structure
- CSSB03437230330
Items Overall 8 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 50 mg | 235.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 352.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 503.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 791.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 1,014.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 1,988.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 2,940.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 4,360.00 |
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