2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol

C12H8Br2O2 — CID 18533301

IUPAC2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol
SMILESOc1ccc(-c2ccc(O)c(Br)c2)cc1Br
InChIInChI=1S/C12H8Br2O2/c13-9-5-7(1-3-11(9)15)8-2-4-12(16)10(14)6-8/h1-6,15-16H
InChIKeyRJGXLSPAKXWJGN-UHFFFAOYSA-N
MW344.00 g/mol
LogP4.29
Rot. Bonds1

About 2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol

2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol (PubChem CID 18533301) has the molecular formula C12H8Br2O2 and a molecular weight of 344.00 g/mol. Its IUPAC name is 2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol.

Molecular Properties

Compound Name2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol
PubChem CID18533301
Molecular FormulaC12H8Br2O2
Molecular Weight344.00 g/mol
Exact Mass341.89
IUPAC Name2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol
SMILESOc1ccc(-c2ccc(O)c(Br)c2)cc1Br
InChIInChI=1S/C12H8Br2O2/c13-9-5-7(1-3-11(9)15)8-2-4-12(16)10(14)6-8/h1-6,15-16H
InChIKeyRJGXLSPAKXWJGN-UHFFFAOYSA-N
XLogP4.29
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.00
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol?
The IUPAC name of 2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol (CID 18533301) is 2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol.
What is the SMILES notation for 2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol?
The canonical SMILES for 2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol is Oc1ccc(-c2ccc(O)c(Br)c2)cc1Br.
What is the InChIKey of 2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol?
The InChIKey is RJGXLSPAKXWJGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Br2O2/c13-9-5-7(1-3-11(9)15)8-2-4-12(16)10(14)6-8/h1-6,15-16H.
What are the key properties of 2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol?
2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol has a molecular weight of 344.00 g/mol, XLogP of 4.29, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-(3-bromo-4-hydroxyphenyl)phenol is sourced from PubChem (CID 18533301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).