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1,2,3,5-tetrahydroxybenzene,1,2,3,5-Benzenetetrol,benzene-1,2,3,5-tetr

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摘 要:1,2,3,5-tetrahydroxybenzene,1,2,3,5-Benzenetetrol,benzene-1,2,3,5-tetrol,CHEBI:16746,1235-TETRAHYDROXYBENZENE,C03743,634-94-6, benzene-1,2,3,5-tetrol,Canonical SMILES: C1=C(C=C(C(=C1O)O)O)O,InChI: InChI=1/C6H6O4/c7-3-1-4(8)6(10)5(9)2-3/h1-2,7-10H,Mol
[Synonyms]
1,2,3,5-tetrahydroxybenzene
1,2,3,5-Benzenetetrol
benzene-1,2,3,5-tetrol
CHEBI:16746
1235-TETRAHYDROXYBENZENE
C03743
634-94-6

[Structure]
1,2,3,5-tetrahydroxybenzene,1,2,3,5-Benzenetetrol,benzene-1,2,3,5-tetr

[ Properties Computed from Structure]
Molecular Weight142.10944 [g/mol]
Molecular FormulaC6H6O4
XLogP0.6
H-Bond Donor4
H-Bond Acceptor4
Rotatable Bond Count0
Tautomer Count15
Exact Mass142.026609
MonoIsotopic Mass142.026609
Topological Polar Surface Area80.9
Heavy Atom Count10
Formal Charge0
Complexity104
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: benzene-1,2,3,5-tetrol
Canonical SMILES: C1=C(C=C(C(=C1O)O)O)O
InChI: InChI=1/C6H6O4/c7-3-1-4(8)6(10)5(9)2-3/h1-2,7-10H

 
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