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1-hydroxy-2-methylanthraquinone
ScientificNameLabel
1-hydroxy-2-methylanthraquinone
PHCD compound ID :
2858
Chemical Names :
1-hydroxy-2-methylanthraquinone
Molecular Formula :
C15H10O3
Molecular Weight :
238.062994
More Details :
Names & Synonyms:
1-hydroxy-2-methyl-anthracene-9,10-dione , 1-hydroxy-2-methylanthracene-9,10-dione , 2-methyl-1-oxidanyl-anthracene-9,10-dione , 1-hydroxy-2-methyl-9,10-anthraquinone
Smiles:
O=C1c2ccccc2C(=O)c2c1ccc(c2O)C
InChi :
InChI=1S/C15H10O3/c1-8-6-7-11-12(13(8)16)15(18)10-5-3-2-4-9(10)14(11)17/h2-7,16H,1H3
InChi Key :
InChIKey=CZODYZFOLUNSFR-UHFFFAOYSA-N
PubChem ID :
160817
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
3
Ionization potential :
9.382324
Hydrogen bond donor count :
1
Electric dipole moment :
0.451
XLogP :
0.89
VDW volume :
214.405862
Molecular weight :
238.062994
HOMO-LUMO gap :
7.697000
Herb list :
Madder - Rubia tinctorum - روناس
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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