| Phytochemical Name : Anthraquinone |
| PCNDIDA0151 |
| Pubchem CID : 6780 |
| Molecular formula: C14H8O2 |
| Canonical SMILES : C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3C2=O |
Synonymes : ANTHRAQUINONE|84-65-1|anthracene-9,10-dione|9,10-Anthraquinone|9,10-Anthracenedione|Anthradione|9,10-Dioxoanthracene|Hoelite|Morkit|Corbit|9,10-Anthrachinon|Anthra-9,10-quinone|Anthrachinon|Anthrapel|9,10-quinone|Az-Q|Avipel|Kawasaki saq|Caswell No. 052A|NSC 7957|9,10-Anthracendion|CCRIS 649|DTXSID3020095|CHEBI:40448|HSDB 2074|Anthracene, 9,10-dihydro-9,10-dioxo-|Anthracene-9,10-quinone|Anthraquinone [BSI:ISO]|UNII-030MS0JBDO|EINECS 201-549-0|030MS0JBDO|9,10-Anthrachinon [Czech]|EPA Pesticide Chemical Code 122701|FLIGHT CONTROL|AI3-09073|NSC-7957|9,10-dihydro-9,10-dioxoanthracene|9,10-dihydroanthracene-9,10-dione|DTXCID9095|CHEMBL55659|NSC7957|EC 201-549-0|NCGC00094960-03|Anthraquinone 100 microg/mL in Acetonitrile|ANTHRAQUINONE (IARC)|ANTHRAQUINONE [IARC]|1,4-bis-[2-(2-hydroxy-ethylamino)-ethylamino]-anthraquinone|CAS-84-65-1|SAQ|dioxoanthracene|anthraquinon-|Anthracenequinone|anthracenequinones|(p) Anthrapel|9,10-antraquinona|MFCD00001188|9,10-Anthraguinone|Anthraquinone, 97%|9,10-Anthracendione|Spectrum_001527|SpecPlus_000645|Spectrum2_000405|Spectrum3_001501|Spectrum4_000907|Spectrum5_001897|an anthraquinone derivative|ANTHRAQUINONE [MI]|Anthra-9,10-quinone #|D0L5LN|Epitope ID:116191|ANTHRAQUINONE [ISO]|ANTHRAQUINONE [HSDB]|ANTHRAQUINONE [INCI]|SCHEMBL14943|BSPBio_003141|KBioGR_001374|KBioSS_002007|DivK1c_006741|SPECTRUM1502103|SPBio_000330|KBio1_001685|KBio2_002007|KBio2_004575|KBio2_007143|KBio3_002641|Anthraquinone, analytical standard|HMS1921J14|HY-N0354|EINECS 292-087-9|Tox21_111369|BDBM50094892|CCG-39966|s5168|STK398385|Anthracene,10-dihydro-9,10-dioxo-|9,10-Dihydro-9,10-diketoanthracene|AKOS000282964|Tox21_111369_1|DS-4810|LS-1837|USEPA/OPP Pesticide Code: 122701|NCGC00094960-01|NCGC00094960-02|NCGC00094960-04|NCGC00094960-06|90530-46-4|AC-12719|Anthraquinone, purum, >=99.0% (HPLC)|A0502|CS-0008907|FT-0622417|Anthraquinone, Vetec(TM) reagent grade, 97%|EN300-71612|A-8000|Anthraquinone, PESTANAL(R), analytical standard|AB-131/40003277|Q423174|SR-01000944707|SR-01000944707-1|BRD-K15957397-001-03-4|Melting point standard 283-286C, analytical standard|F0001-2133|Z1142688857|71730-08-0|9,10-anthraquinone;9,10-anthracenedione;anthraquinone;anthracene-9,10-dione;9,10-anthraquinone 9,10-anthracenedione anthraquinone anthracene-9,10-dione|9TA |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.940 |
| Log Po/w (XLOGP3) : 3.390 |
| Log Po/w (WLOGP) : 2.460 |
| Log Po/w (MLOGP) : 1.860 |
| Log Po/w (SILICOS-IT) : 3.560 |
| Consensus Log Po/w : 2.640 |