2,6-dibromo-4-(3,5-dibromo-4-hydroxybenzenesulfonyl)phenol

2,6-dibromo-4-(3,5-dibromo-4-hydroxybenzenesulfonyl)phenol

CAS: 39635-79-5

Formula: C12H6Br4O4S

SMILES: OC1=C(Br)C=C(C=C1Br)S(=O)(=O)C1=CC(Br)=C(O)C(Br)=C1

IUPAC: 2,6-dibromo-4-(3,5-dibromo-4-hydroxybenzenesulfonyl)phenol

InChI: InChI=1S/C12H6Br4O4S/c13-7-1-5(2-8(14)11(7)17)21(19,20)6-3-9(15)12(18)10(16)4-6/h1-4,17-18H

Composition: C (25.47%), H (1.07%), Br (56.48%), O (11.31%), S (5.67%)

Molar Mass: 565.85

Atom Count: 27

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	561.672032
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	JHJUYGMZIWDHMO-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	94.04
Topological Polar Surface Area	74.6
Polarizability	37.8
Ring Count	2
Rotatable Bond Count	2

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