RLM

2,6-bis(chloranyl)-4-[(4-hydroxyphenyl)amino]phenol

Created: 2013-05-13
Last modified:  2014-09-05

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Chemical Details

Formal Charge0
Atom Count26
Chiral Atom Count0
Bond Count27
Aromatic Bond Count12
2D diagram of RLM

Chemical Component Summary

Name2,6-bis(chloranyl)-4-[(4-hydroxyphenyl)amino]phenol
Systematic Name (OpenEye OEToolkits)2,6-bis(chloranyl)-4-[(4-hydroxyphenyl)amino]phenol
FormulaC12 H9 Cl2 N O2
Molecular Weight270.111
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01Clc1cc(cc(Cl)c1O)Nc2ccc(O)cc2
SMILESCACTVS3.385Oc1ccc(Nc2cc(Cl)c(O)c(Cl)c2)cc1
SMILESOpenEye OEToolkits1.9.2c1cc(ccc1Nc2cc(c(c(c2)Cl)O)Cl)O
Canonical SMILESCACTVS3.385 Oc1ccc(Nc2cc(Cl)c(O)c(Cl)c2)cc1
Canonical SMILESOpenEye OEToolkits1.9.2 c1cc(ccc1Nc2cc(c(c(c2)Cl)O)Cl)O
InChIInChI1.03 InChI=1S/C12H9Cl2NO2/c13-10-5-8(6-11(14)12(10)17)15-7-1-3-9(16)4-2-7/h1-6,15-17H
InChIKeyInChI1.03 IFTGQCOAUCEONK-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 622906