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1,3-dihydroxyanthraquinone
PHCD compound ID : 2861
Chemical Names :
1,3-dihydroxyanthraquinone
Molecular Formula : C14H8O4
Molecular Weight : 240.042259
More Details :
Names & Synonyms: 1,3-dihydroxyanthracene-9,10-dione , 1,3-bis(oxidanyl)anthracene-9,10-dione , 1,3-dihydroxy-9,10-anthraquinone
Smiles: Oc1cc(O)c2c(c1)C(=O)c1c(C2=O)cccc1
InChi : InChI=1S/C14H8O4/c15-7-5-10-12(11(16)6-7)14(18)9-4-2-1-3-8(9)13(10)17/h1-6,15-16H
InChi Key : InChIKey=WPWWKBNOXTZDQJ-UHFFFAOYSA-N
PubChem ID : 196978
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 9.614161
Hydrogen bond donor count : 2 Electric dipole moment : 1.253
XLogP : 0.628 VDW volume : 205.900105
Molecular weight : 240.042259 HOMO-LUMO gap : 8.041000
Herb list :
Refrences & Litretures:
  
360.      Journal:'Int J Adv Biol Biom Res'      Year:'2013'      Volume:'1'      Page:'1315'      DOI:''      Title:'Rubia tinctorum L. (Rubiaceae) or Madder as one of the living color to dyeing wool'
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