2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol

C12H7Cl3O3 — CID 122646985

IUPAC2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol
SMILESOc1ccc(Cl)c(Oc2cc(Cl)c(O)c(Cl)c2)c1
InChIInChI=1S/C12H7Cl3O3/c13-8-2-1-6(16)3-11(8)18-7-4-9(14)12(17)10(15)5-7/h1-5,16-17H
InChIKeyRXWSIEGQWBJYDI-UHFFFAOYSA-N
MW305.54 g/mol
LogP4.85
Rot. Bonds2

About 2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol

2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol (PubChem CID 122646985) has the molecular formula C12H7Cl3O3 and a molecular weight of 305.54 g/mol. Its IUPAC name is 2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol.

Molecular Properties

Compound Name2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol
PubChem CID122646985
Molecular FormulaC12H7Cl3O3
Molecular Weight305.54 g/mol
Exact Mass303.95
IUPAC Name2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol
SMILESOc1ccc(Cl)c(Oc2cc(Cl)c(O)c(Cl)c2)c1
InChIInChI=1S/C12H7Cl3O3/c13-8-2-1-6(16)3-11(8)18-7-4-9(14)12(17)10(15)5-7/h1-5,16-17H
InChIKeyRXWSIEGQWBJYDI-UHFFFAOYSA-N
XLogP4.85
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.54
LogP ≤ 54.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-dichloro-4-(4-chlorophenoxy)phenol
CID 21278927
2,5-dichloro-4-(4-hydroxyphenoxy)phenol
CID 14591774
4-chloro-3-[(4-fluorophenyl)methoxy]phenol
CID 155746244
(2-chloro-5-hydroxyphenyl) propanoate
CID 101441480
4-chlorobenzene-1,3-diol
CID 1731
bis(3,4-dichlorophenol);zirconium
CID 161397670
4-chloro-3-[[4-(trifluoromethyl)phenyl]methoxy]phenol
CID 142618666
(2-chloro-4-hydroxyphenyl) hypochlorite
CID 174920308
2-bromo-6-chloro-4-phenoxyphenol
CID 164893883
3,4-bis(4-methoxyphenoxy)phenol
CID 139941919
3,5-dichloro-4-[(4-chloro-3-phenoxyphenyl)methoxy]phenol
CID 54082853
5-(2,3-dihydroxyphenoxy)benzene-1,2,3-triol
CID 19426542

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol?
The IUPAC name of 2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol (CID 122646985) is 2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol.
What is the SMILES notation for 2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol?
The canonical SMILES for 2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol is Oc1ccc(Cl)c(Oc2cc(Cl)c(O)c(Cl)c2)c1.
What is the InChIKey of 2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol?
The InChIKey is RXWSIEGQWBJYDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7Cl3O3/c13-8-2-1-6(16)3-11(8)18-7-4-9(14)12(17)10(15)5-7/h1-5,16-17H.
What are the key properties of 2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol?
2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol has a molecular weight of 305.54 g/mol, XLogP of 4.85, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-4-(2-chloro-5-hydroxyphenoxy)phenol is sourced from PubChem (CID 122646985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).