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141032-55-5 | 9,10-Anthracenedione, 1,4,6,7-tetrahydroxy-
CAS No: 141032-55-5 Catalog No: AG001FS0 MDL No:
Product Description
Catalog Number:
AG001FS0
Chemical Name:
9,10-Anthracenedione, 1,4,6,7-tetrahydroxy-
CAS Number:
141032-55-5
Molecular Formula:
C14H8O6
Molecular Weight:
272.2097
IUPAC Name:
1,4,6,7-tetrahydroxyanthracene-9,10-dione
InChI:
InChI=1S/C14H8O6/c15-7-1-2-8(16)12-11(7)13(19)5-3-9(17)10(18)4-6(5)14(12)20/h1-4,15-18H
InChI Key:
KYGZSKNTTJLPMR-UHFFFAOYSA-N
SMILES:
Oc1cc2c(cc1O)C(=O)c1c(C2=O)c(O)ccc1O
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.032g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
272.212g/mol
Monoisotopic Mass:
272.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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