Trisodium 5-{[(1E)-3-carboxylato-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene](2,6-dichloro-3-sulfonatophenyl)methyl}-2-hydroxy-3-methylbenzoate
Structure Info
- Chemspace ID
- CSSB00016994774 (In-Stock Building Blocks)
- MFCD
- MFCD00001615
- IUPAC Name
- trisodium 5-{[(1E)-3-carboxylato-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene](2,6-dichloro-3-sulfonatophenyl)methyl}-2-hydroxy-3-methylbenzoate
- Mol formula
- C23H13Cl2Na3O9S
- Mol weight
- 605 Da
- Catalog Number(s)
- A490004228, AKOS024380590, BBLS00016994774, C0979, CSC016994774, D0241, D89339, FC15428, bbls00016994774
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 5.35
- Heavy atoms count
- 38
- Rotatable bond count
- 5
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.086
- Polar surface area (Å)
- 175
- Hydrogen bond acceptors count
- 9
- Hydrogen bond donors count
- 1
methyl}-2-hydroxy-3-methylbenzoate (C23H13Cl2Na3O9S) - CSSB00016994774](/st/structure/200/6c321d2c6896c384de5331fcbc805e40/%255BNa%252B%255D.%255BNa%252B%255D.%255BNa%252B%255D.CC1%253DC%255CC%2528C%253DC%2528C%2528%255BO-%255D%2529%253DO%2529C1%253DO%2529%253DC%2528%255CC1%253DCC%2528C%2529%253DC%2528O%2529C%2528%253DC1%2529C%2528%255BO-%255D%2529%253DO%2529C1%253DC%2528Cl%2529C%253DCC%2528%253DC1Cl%2529S%2528%255BO-%255D%2529%2528%253DO%2529%253DO.png "C23H13Cl2Na3O9S")
- Zoom the structure
- CSSB00016994774
Items Overall 9 items from 3 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Astatech Inc | 2 days | United States To: | 95 | 1 g | 38.50 | |
| Astatech Inc | 2 days | United States To: | 95 | 5 g | 71.50 | |
| Astatech Inc | 2 days | United States To: | 95 | 25 g | 144.10 | |
Description: MORDANT BLUE 29; CAS: 1667-99-8 | ||||||
| BB4LS GS | 15 days | Latvia To: | 95 | 50 umol | 37.42 | |
| BB4LS GS | 15 days | Latvia To: | 95 | 100 umol | 38.12 | |
| BB4LS GS | 15 days | Latvia To: | 95 | 200 umol | 38.81 | |
| BB4LS GS | 15 days | Latvia To: | 95 | 300 umol | 39.50 | |
| BB4LS GS | 15 days | Latvia To: | 95 | 500 umol | 40.19 | |
| TCI America | TBD | United States To: | 90 | 25 g | 44.55 | |
Description: Mordant Blue 29, C23H16Cl2O9S, CHClNaOS, 605.28 g/mol; CAS: 1667-99-8 | ||||||
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