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7-hydroxy-2-methylanthraquinone
ScientificNameLabel
7-hydroxy-2-methylanthraquinone
PHCD compound ID :
2862
Chemical Names :
7-hydroxy-2-methylanthraquinone
Molecular Formula :
C15H10O3
Molecular Weight :
238.062994
More Details :
Names & Synonyms:
2-hydroxy-7-methyl-anthracene-9,10-dione , 2-hydroxy-7-methylanthracene-9,10-dione , 2-methyl-7-oxidanyl-anthracene-9,10-dione , 2-hydroxy-7-methyl-9,10-anthraquinone
Smiles:
Cc1ccc2c(c1)C(=O)c1c(C2=O)ccc(c1)O
InChi :
InChI=1S/C15H10O3/c1-8-2-4-10-12(6-8)15(18)13-7-9(16)3-5-11(13)14(10)17/h2-7,16H,1H3
InChi Key :
InChIKey=UMJCTADKPMCLGQ-UHFFFAOYSA-N
PubChem ID :
150722
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
3
Ionization potential :
9.692415
Hydrogen bond donor count :
1
Electric dipole moment :
2.255
XLogP :
1.101
VDW volume :
214.405862
Molecular weight :
238.062994
HOMO-LUMO gap :
8.124000
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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