(²H?)benzene-1,3,5-triol

(²H?)benzene-1,3,5-triol

CAS: 1036711-64-4

Formula: C6H6O3

SMILES: [2H]C1=C(O)C([2H])=C(O)C([2H])=C1O

IUPAC: (²H?)benzene-1,3,5-triol

InChI: InChI=1S/C6H6O3/c7-4-1-5(8)3-6(9)2-4/h1-3,7-9H/i1D,2D,3D

Composition: C (55.81%), H (2.34%), [2H] (4.68%), O (37.17%)

Molar Mass: 129.129

Atom Count: 15

Heavy Atom Count: 9

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	129.050524291
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
InChIKey	QCDYQQDYXPDABM-CBYSEHNBSA-N
Lipinski's Rule of Five	1
Molar Refractivity	32
Topological Polar Surface Area	60.69
Polarizability	12.18
Ring Count	1
Rotatable Bond Count	0

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