2,2'-dimethyl 4,4'-dihydroxy-[1,1'-biphenyl]-2,2'-dicarboxylate
Structure Info
- Chemspace ID
- CSSB06583918397 (In-Stock Building Blocks)
- IUPAC Name
- 2,2'-dimethyl 4,4'-dihydroxy-[1,1'-biphenyl]-2,2'-dicarboxylate
- Mol formula
- C16H14O6
- Mol weight
- 302 Da
- Catalog Number(s)
- AR03328K, EC0333PC, ST03330C
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.02
- Heavy atoms count
- 22
- Rotatable bond count
- 5
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.125
- Polar surface area (Å)
- 93
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 2
![Chemical structure of 2,2'-dimethyl 4,4'-dihydroxy-[1,1'-biphenyl]-2,2'-dicarboxylate (C16H14O6) - CSSB06583918397](/st/structure/200/31e787716c23e6b31a381fb80b05a686/COC%2528%253DO%2529C1%253DC%2528C2%253DCC%253DC%2528O%2529C%253DC2C%2528%253DO%2529OC%2529C%253DCC%2528O%2529%253DC1.png "C16H14O6")
- Zoom the structure
- CSSB06583918397
Items Overall 3 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Accel Scientific, S.L. | 20 days | China To: | 95 | 100 mg | 584.10 | |
| Accel Scientific, S.L. | 20 days | China To: | 95 | 250 mg | 768.90 | |
| Accel Scientific, S.L. | 20 days | China To: | 95 | 1 g | 1,505.90 | |
Description: methyl5-hydroxy-2-(4-hydroxy-2-methoxycarbonylphenyl)benzoate; CAS: 101110-86-5 | ||||||
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Substructure Analogs
![Chemical structure of methyl 7-methoxy-4-[7-methoxy-5-(methoxycarbonyl)-2H-1,3-benzodioxol-4-yl]-2H-1,3-benzodioxole-5-carboxylate - CSSB00016987471](/st/structure/200/31cb4949dfe41f518e6c88b2ca308169/COC%2528%253DO%2529C1%253DCC%2528OC%2529%253DC2OCOC2%253DC1C1%253DC2OCOC2%253DC%2528OC%2529C%253DC1C%2528%253DO%2529OC.png)
![Chemical structure of (10S,11R,12R,13S,15R)-13-(4-acetyl-3,5-dihydroxyphenoxy)-3,4,5,11,12,21,22,23-octahydroxy-9,14,17-trioxatetracyclo[17.4.0.0²,⁷.0¹⁰,¹⁵]tricosa-1(19),2,4,6,20,22-hexaene-8,18-dione - CSSB09881014234](/st/structure/200/f587ac7bb4c7e6422813c00cc0f8b04d/CC%2528%253DO%2529C1%253DC%2528O%2529C%253DC%2528O%255BC%2540%2540H%255D2O%255BC%2540%2540H%255D3COC%2528%253DO%2529C4%253DC%2528C%2528O%2529%253DC%2528O%2529C%2528O%2529%253DC4%2529C4%253DC%2528O%2529C%2528O%2529%253DC%2528O%2529C%253DC4C%2528%253DO%2529O%255BC%2540H%255D3%255BC%2540H%255D%2528O%2529%255BC%2540H%255D2O%2529C%253DC1O.png)
![Chemical structure of (1R,19R,21S,22S,23S)-6,7,8,11,12,13,22,23-octahydroxy-3,16-dioxo-2,17,20-trioxatetracyclo[17.3.1.0⁴,⁹.0¹⁰,¹⁵]tricosa-4,6,8,10,12,14-hexaen-21-yl 3,4,5-trihydroxybenzoate - CSSB00161189899](/st/structure/200/d48631c85ef36390c4df489817866153/O%255BC%2540H%255D1%255BC%2540H%255D2COC%2528%253DO%2529C3%253DCC%2528O%2529%253DC%2528O%2529C%2528O%2529%253DC3C3%253DC%2528O%2529C%2528O%2529%253DC%2528O%2529C%253DC3C%2528%253DO%2529O%255BC%2540H%255D1%255BC%2540H%255D%2528O%2529%255BC%2540H%255D%2528OC%2528%253DO%2529C1%253DCC%2528O%2529%253DC%2528O%2529C%2528O%2529%253DC1%2529O2.png)
![Chemical structure of 3,4,5,11,12,21,22,23-octahydroxy-8,18-dioxo-9,14,17-trioxatetracyclo[17.4.0.0²,⁷.0¹⁰,¹⁵]tricosa-1(23),2,4,6,19,21-hexaen-13-yl 3,4,5-trihydroxybenzoate - CSSB14948337656](/st/structure/200/9bf920b636dc843ea74facc7183eb2f8/OC1C%2528O%2529C2OC%2528%253DO%2529C3%253DCC%2528O%2529%253DC%2528O%2529C%2528O%2529%253DC3C3%253DC%2528O%2529C%2528O%2529%253DC%2528O%2529C%253DC3C%2528%253DO%2529OCC2OC1OC%2528%253DO%2529C1%253DCC%2528O%2529%253DC%2528O%2529C%2528O%2529%253DC1.png)
![Chemical structure of (1S,19R,21S,22R,23R)-6,7,8,11,12,13,22,23-octahydroxy-3,16-dioxo-2,17,20-trioxatetracyclo[17.3.1.0⁴,⁹.0¹⁰,¹⁵]tricosa-4,6,8,10,12,14-hexaen-21-yl 3,4,5-trihydroxybenzoate - CSSB00116207018](/st/structure/200/385ad172e255cb3bcc836077139f14bc/O%255BC%2540%2540H%255D1%255BC%2540H%255D2COC%2528%253DO%2529C3%253DCC%2528O%2529%253DC%2528O%2529C%2528O%2529%253DC3C3%253DC%2528O%2529C%2528O%2529%253DC%2528O%2529C%253DC3C%2528%253DO%2529O%255BC%2540%2540H%255D1%255BC%2540%2540H%255D%2528O%2529%255BC%2540H%255D%2528OC%2528%253DO%2529C1%253DCC%2528O%2529%253DC%2528O%2529C%2528O%2529%253DC1%2529O2.png)
![Chemical structure of (10S,11R,12R,13S,15R)-13-[3,5-dihydroxy-4-(3-phenylpropanoyl)phenoxy]-3,4,5,11,12,21,22,23-octahydroxy-9,14,17-trioxatetracyclo[17.4.0.0²,⁷.0¹⁰,¹⁵]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione - CSSB06595026078](/st/structure/200/38cb085085479344218e16c1dc44afc2/O%255BC%2540%2540H%255D1%255BC%2540%2540H%255D%2528O%2529%255BC%2540%2540H%255D2OC%2528%253DO%2529c3cc%2528O%2529c%2528O%2529c%2528O%2529c3-c3c%2528O%2529c%2528O%2529c%2528O%2529cc3C%2528%253DO%2529OC%255BC%2540H%255D2O%255BC%2540H%255D1Oc1cc%2528O%2529c%2528C%2528%253DO%2529CCc2ccccc2%2529c%2528O%2529c1.png)
![Chemical structure of 13-[3,5-dihydroxy-4-(3-phenylpropanoyl)phenoxy]-3,4,5,11,12,21,22,23-octahydroxy-9,14,17-trioxatetracyclo[17.4.0.0²,⁷.0¹⁰,¹⁵]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione - CSSB06744482941](/st/structure/200/4edb498789ce117a5028f3418a3c5660/OC1C%2528O%2529C2OC%2528%253DO%2529c3cc%2528O%2529c%2528O%2529c%2528O%2529c3-c3c%2528O%2529c%2528O%2529c%2528O%2529cc3C%2528%253DO%2529OCC2OC1Oc1cc%2528O%2529c%2528C%2528%253DO%2529CCc2ccccc2%2529c%2528O%2529c1.png)
Similarity Analogs
![Chemical structure of methyl 4,4'-dihydroxy-[1,1'-biphenyl]-2-carboxylate - CSSB06586157518](/st/structure/200/c43b1c127deb6b6793a776607b0b8415/COC%2528%253DO%2529C1%253DCC%2528O%2529%253DCC%253DC1C1%253DCC%253DC%2528O%2529C%253DC1.png)
![Chemical structure of methyl 4-hydroxy-[1,1'-biphenyl]-2-carboxylate - CSSB06583918803](/st/structure/200/f66245b760f093df5c604a33e534c14b/COC%2528%253DO%2529C1%253DC%2528C2%253DCC%253DCC%253DC2%2529C%253DCC%2528O%2529%253DC1.png)
![Chemical structure of methyl 4-hydroxy-2'-methoxy-[1,1'-biphenyl]-2-carboxylate - CSSB06581810201](/st/structure/200/634c201e1a8a72f710b0e7278e645b5b/COC%2528%253DO%2529C1%253DCC%2528O%2529%253DCC%253DC1C1%253DC%2528OC%2529C%253DCC%253DC1.png)
