Tetrasodium 2-[({3-[1-(3-{[bis(carboxylatomethyl)amino]methyl}-4-hydroxy-2-methyl-5-(propan-2-yl)phenyl)-3-oxo-1,3-dihydro-2-benzofuran-1-yl]-6-hydroxy-2-methyl-5-(propan-2-yl)phenyl}methyl)(carboxylatomethyl)amino]acetate
Structure Info
- Chemspace ID
- CSSB03549785514 (In-Stock Building Blocks)
- CAS
- 62698-55-9
- MFCD
- MFCD16661172
- IUPAC Name
- tetrasodium 2-[({3-[1-(3-{[bis(carboxylatomethyl)amino]methyl}-4-hydroxy-2-methyl-5-(propan-2-yl)phenyl)-3-oxo-1,3-dihydro-2-benzofuran-1-yl]-6-hydroxy-2-methyl-5-(propan-2-yl)phenyl}methyl)(carboxylatomethyl)amino]acetate
- Mol formula
- C38H40N2Na4O12
- Mol weight
- 809 Da
- Catalog Number(s)
- 62698-55-9, AA00EGP9, ACM62698559, ADB3943672001, AG00EGS1, AG74729, AO74729, BBLS03549785514, BD01050493, EC00EIXT, FT46553, LN04632307, OR1107340, R314079, ST00EI8T, T80988, TX00EHXP, Y3104314, ZXC413871, bbls03549785514
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.11
- Heavy atoms count
- 56
- Rotatable bond count
- 16
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.394
- Polar surface area (Å)
- 234
- Hydrogen bond acceptors count
- 13
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSSB03549785514
Items Overall 20 items from 8 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Angene International Limited | 10 days | China To: | 90 | 1 g | 15.30 | |
| Angene International Limited | 10 days | China To: | 90 | 5 g | 28.80 | |
| Angene International Limited | 10 days | China To: | 90 | 25 g | 117.00 | |
| Angene International Limited | 10 days | China To: | 90 | 100 g | 369.00 | |
Description: N,N′-[(3-Oxo-1(3H)-isobenzofuranylidene)bis[[6-hydroxy-2-methyl-5-(1-methylethyl)-3,1-phenylene]methylene]]bis[N-(carboxymethyl)glycine] tetrasodium salt; CAS: 62698-55-9 | ||||||
| A2B Chem | 12 days | United States To: | 90 | 1 g | 36.80 | |
Description: N,N′-[(3-Oxo-1(3H)-isobenzofuranylidene)bis[[6-hydroxy-2-methyl-5-(1-methylethyl)-3,1-phenylene]methylene]]bis[N-(carboxymethyl)glycine] tetrasodium salt; CAS: 62698-55-9 | ||||||
| AA BLOCKS | 12 days | United States To: | 90 | 1 g | 42.90 | |
Description: N,N′-[(3-Oxo-1(3H)-isobenzofuranylidene)bis[[6-hydroxy-2-methyl-5-(1-methylethyl)-3,1-phenylene]methylene]]bis[N-(carboxymethyl)glycine] tetrasodium salt; CAS: 62698-55-9 | ||||||
| 1st Scientific CN | 14 days | China To: | 90 | 1 g | 24.20 | |
| 1st Scientific CN | 14 days | China To: | 90 | 5 g | 51.70 | |
| 1st Scientific CN | 14 days | China To: | 90 | 10 g | 52.80 | |
Description: N,N′-[(3-Oxo-1(3H)-isobenzofuranylidene)bis[[6-hydroxy-2-methyl-5-(1-methylethyl)-3,1-phenylene]methylene]]bis[N-(carboxymethyl)glycine] tetrasodium salt; CAS: 62698-55-9 | ||||||
| BB4LS GS | 15 days | Latvia To: | 90 | 50 umol | 31.01 | |
| BB4LS GS | 15 days | Latvia To: | 90 | 100 umol | 31.58 | |
| BB4LS GS | 15 days | Latvia To: | 90 | 200 umol | 32.16 | |
| BB4LS GS | 15 days | Latvia To: | 90 | 300 umol | 32.73 | |
| BB4LS GS | 15 days | Latvia To: | 90 | 500 umol | 33.30 | |
| Accel Scientific, S.L. | 20 days | China To: | 90 | 1 g | 45.10 | |
Description: N,N′-[(3-Oxo-1(3H)-isobenzofuranylidene)bis[[6-hydroxy-2-methyl-5-(1-methylethyl)-3,1-phenylene]methylene]]bis[N-(carboxymethyl)glycine] tetrasodium salt; CAS: 62698-55-9 | ||||||
| eNovation CN | 20 days | China To: | 95 | 1 g | 132.25 | |
| eNovation CN | 20 days | China To: | 95 | 5 g | 149.50 | |
| eNovation CN | 20 days | China To: | 95 | 25 g | 247.25 | |
| eNovation CN | 20 days | China To: | 95 | 100 g | 563.50 | |
Description: N,N-[(3-Oxo-1(3H)-isobenzofuranylidene)bis[[6-hydroxy-2-methyl-5-(1-methylethyl)-3,1-phenylene]methylene]]bis[N-(carboxymethyl)glycine] tetrasodium salt; CAS: 62698-55-9 | ||||||
| 10X CHEM | TBD | United States To: | 90 | 1 g | 31.90 | |
Description: N,N′-[(3-Oxo-1(3H)-isobenzofuranylidene)bis[[6-hydroxy-2-methyl-5-(1-methylethyl)-3,1-phenylene]methylene]]bis[N-(carboxymethyl)glycine] tetrasodium salt; CAS: 62698-55-9 | ||||||
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![Chemical structure of 2-[({3-[1-(3-{[bis(carboxymethyl)amino]methyl}-4-hydroxy-2-methyl-5-(propan-2-yl)phenyl)-3-oxo-1,3-dihydro-2-benzofuran-1-yl]-6-hydroxy-2-methyl-5-(propan-2-yl)phenyl}methyl)(carboxymethyl)amino]acetic acid - CSSB02125554227](/st/structure/200/efbc4aa8a935216b9e6d4374b7bc2621/CC%2528C%2529C1%253DCC%2528%253DC%2528C%2529C%2528CN%2528CC%2528O%2529%253DO%2529CC%2528O%2529%253DO%2529%253DC1O%2529C1%2528OC%2528%253DO%2529C2%253DCC%253DCC%253DC12%2529C1%253DCC%2528C%2528C%2529C%2529%253DC%2528O%2529C%2528CN%2528CC%2528O%2529%253DO%2529CC%2528O%2529%253DO%2529%253DC1C.png)
![Chemical structure of tetrasodium 2-[({3-[3-(3-{[bis(carboxylatomethyl)amino]methyl}-4-hydroxy-2-methyl-5-(propan-2-yl)phenyl)-1,1-dioxo-3H-2,1λ⁶-benzoxathiol-3-yl]-6-hydroxy-2-methyl-5-(propan-2-yl)phenyl}methyl)(carboxylatomethyl)amino]acetate - CSSB02125556033](/st/structure/200/6a008132ca8b54ed4b31d0634cad7106/%255BNa%252B%255D.%255BNa%252B%255D.%255BNa%252B%255D.%255BNa%252B%255D.CC%2528C%2529C1%253DCC%2528%253DC%2528C%2529C%2528CN%2528CC%2528%255BO-%255D%2529%253DO%2529CC%2528%255BO-%255D%2529%253DO%2529%253DC1O%2529C1%2528OS%2528%253DO%2529%2528%253DO%2529C2%253DCC%253DCC%253DC12%2529C1%253DCC%2528C%2528C%2529C%2529%253DC%2528O%2529C%2528CN%2528CC%2528%255BO-%255D%2529%253DO%2529CC%2528%255BO-%255D%2529%253DO%2529%253DC1C.png)
![Chemical structure of tetrasodium 2-[({5-[1-(3-{[bis(carboxylatomethyl)amino]methyl}-4-hydroxy-5-methylphenyl)-3-oxo-1,3-dihydro-2-benzofuran-1-yl]-2-hydroxy-3-methylphenyl}methyl)(carboxylatomethyl)amino]acetate - CSSB00016994796](/st/structure/200/3db09c89d677c8453dcb8f138bff07a1/%255BNa%252B%255D.%255BNa%252B%255D.%255BNa%252B%255D.%255BNa%252B%255D.CC1%253DCC%2528%253DCC%2528CN%2528CC%2528%255BO-%255D%2529%253DO%2529CC%2528%255BO-%255D%2529%253DO%2529%253DC1O%2529C1%2528OC%2528%253DO%2529C2%253DCC%253DCC%253DC12%2529C1%253DCC%2528C%2529%253DC%2528O%2529C%2528CN%2528CC%2528%255BO-%255D%2529%253DO%2529CC%2528%255BO-%255D%2529%253DO%2529%253DC1.png)
![Chemical structure of sodium 2-[({5-[1-(3-{[bis(carboxymethyl)amino]methyl}-4-hydroxy-5-methylphenyl)-3-oxo-1,3-dihydro-2-benzofuran-1-yl]-2-hydroxy-3-methylphenyl}methyl)(carboxymethyl)amino]acetate - CSSB02515451281](/st/structure/200/f057b03ae1f0130c2544da6d502355ea/%255BNa%252B%255D.CC1%253DCC%2528%253DCC%2528CN%2528CC%2528O%2529%253DO%2529CC%2528O%2529%253DO%2529%253DC1O%2529C1%2528OC%2528%253DO%2529C2%253DCC%253DCC%253DC12%2529C1%253DCC%2528C%2529%253DC%2528O%2529C%2528CN%2528CC%2528O%2529%253DO%2529CC%2528%255BO-%255D%2529%253DO%2529%253DC1.png)
![Chemical structure of sodium 2-{[(2'-{[bis(carboxymethyl)amino]methyl}-3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthen]-7'-yl)methyl](carboxymethyl)amino}acetate - CSSB02516458647](/st/structure/200/a00a34e17249ca11f737ff3a88431b0b/%255BNa%252B%255D.OC%2528%253DO%2529CN%2528CC%2528O%2529%253DO%2529CC1%253DCC2%253DC%2528OC3%253DCC%2528O%2529%253DC%2528CN%2528CC%2528O%2529%253DO%2529CC%2528%255BO-%255D%2529%253DO%2529C%253DC3C22OC%2528%253DO%2529C3%253DCC%253DCC%253DC23%2529C%253DC1O.png)
![Chemical structure of sodium 2-{[(3-{3-[3-({bis[2-oxo-2-(sodiooxy)ethyl]amino}methyl)-4-hydroxy-2-methyl-5-(propan-2-yl)phenyl]-1,1-dioxo-3H-2,1λ⁶-benzoxathiol-3-yl}-6-hydroxy-2-methyl-5-(propan-2-yl)phenyl)methyl][2-oxo-2-(sodiooxy)ethyl]amino}acetate - CSSB06744598074](/st/structure/200/b6bb543d3b93ae8f368808c0be547ae4/CC%2528C%2529c1cc%2528c%2528C%2529c%2528CN%2528CC%2528%253DO%2529O%255BNa%255D%2529CC%2528%253DO%2529O%255BNa%255D%2529c1O%2529C1%2528OS%2528%253DO%2529%2528%253DO%2529c2ccccc12%2529c1cc%2528C%2528C%2529C%2529c%2528O%2529c%2528CN%2528CC%2528%253DO%2529O%255BNa%255D%2529CC%2528%253DO%2529O%255BNa%255D%2529c1C.png)
![Chemical structure of tetrasodium 2-[(carboxylatomethyl)({3-[(3-{[(carboxylatomethyl)(carboxymethyl)amino]methyl}-4-hydroxy-2-methyl-5-(propan-2-yl)phenyl)(2-sulfonatophenyl)methylidene]-2-methyl-6-oxo-5-(propan-2-yl)cyclohexyl}methyl)amino]acetate - CSSB02495363048](/st/structure/200/69295838184d0453ae989d23b5eedf7d/%255BNa%252B%255D.%255BNa%252B%255D.%255BNa%252B%255D.%255BNa%252B%255D.CC%2528C%2529C1CC%2528C%2528C%2529C%2528CN%2528CC%2528%255BO-%255D%2529%253DO%2529CC%2528%255BO-%255D%2529%253DO%2529C1%253DO%2529%253DC%2528C1%253DCC%2528C%2528C%2529C%2529%253DC%2528O%2529C%2528CN%2528CC%2528O%2529%253DO%2529CC%2528%255BO-%255D%2529%253DO%2529%253DC1C%2529C1%253DCC%253DCC%253DC1S%2528%255BO-%255D%2529%2528%253DO%2529%253DO.png)
