| Phytochemical Name : 9,10-Anthracenediyl-bis(methylene)dimalonic acid |
| PCNDIDOT1054 |
| Pubchem CID : 3458978 |
| Molecular formula: C22H18O8 |
| Canonical SMILES : C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2CC(C(=O)O)C(=O)O)CC(C(=O)O)C(=O)O |
Synonymes : 307554-62-7|9,10-Anthracenediyl-bis(methylene)dimalonic acid|2-[[10-(2,2-dicarboxyethyl)anthracen-9-yl]methyl]propanedioic Acid|2,2'-(Anthracene-9,10-diylbis(methylene))dimalonic acid|9,10-Anthracenedipropanoic acid, alpha9,alpha10-dicarboxy-|m-Hydroxybenzoicacid|SCHEMBL592418|DTXSID70392681|9 10-Anthracenediyl-bis(methylene)|MFCD03095464|AKOS015916223|AS-76549|D94640|[(9,10-Anthracenediyl)bismethylene]dimalonic acid|9,10-anthracenediyl-bis(methylene) dimalonic acid|J-100029|9,10-Anthracenedipropanoic acid, a9,a10-dicarboxy-|2,2'-(Anthracene-9,10-diylbis(methylene))dimalonicacid|9,10-Anthracenediyl-bis(methylene)dimalonic acid, BioReagent, suitable for fluorescence, >=90% (HPCE) |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 0.570 |
| Log Po/w (XLOGP3) : 3.270 |
| Log Po/w (WLOGP) : 2.650 |
| Log Po/w (MLOGP) : 2.140 |
| Log Po/w (SILICOS-IT) : 2.720 |
| Consensus Log Po/w : 2.270 |