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20324-66-7 | 9,10-Anthracenedione, 1,2,4,5-tetrahydroxy-7-methyl-
CAS No: 20324-66-7 Catalog No: AG0028RD MDL No:
Product Description
Catalog Number:
AG0028RD
Chemical Name:
9,10-Anthracenedione, 1,2,4,5-tetrahydroxy-7-methyl-
CAS Number:
20324-66-7
Molecular Formula:
C15H10O6
Molecular Weight:
286.2363
IUPAC Name:
1,2,4,5-tetrahydroxy-7-methylanthracene-9,10-dione
InChI:
InChI=1S/C15H10O6/c1-5-2-6-10(7(16)3-5)15(21)11-8(17)4-9(18)14(20)12(11)13(6)19/h2-4,16-18,20H,1H3
InChI Key:
ITCNKLLBKUYLLV-UHFFFAOYSA-N
SMILES:
Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1O)O
UNII:
CYY76OBH78
Properties
Complexity:
463
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.048g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
286.239g/mol
Monoisotopic Mass:
286.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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