2-bromo-5-chloro-4-methoxyphenol

C7H6BrClO2 — CID 84700319

IUPAC2-bromo-5-chloro-4-methoxyphenol
SMILESCOc1cc(Br)c(O)cc1Cl
InChIInChI=1S/C7H6BrClO2/c1-11-7-2-4(8)6(10)3-5(7)9/h2-3,10H,1H3
InChIKeyGXLLFLVFSKBTKH-UHFFFAOYSA-N
MW237.48 g/mol
LogP2.82
Rot. Bonds1

About 2-bromo-5-chloro-4-methoxyphenol

2-bromo-5-chloro-4-methoxyphenol (PubChem CID 84700319) has the molecular formula C7H6BrClO2 and a molecular weight of 237.48 g/mol. Its IUPAC name is 2-bromo-5-chloro-4-methoxyphenol.

Molecular Properties

Compound Name2-bromo-5-chloro-4-methoxyphenol
PubChem CID84700319
Molecular FormulaC7H6BrClO2
Molecular Weight237.48 g/mol
Exact Mass235.92
IUPAC Name2-bromo-5-chloro-4-methoxyphenol
SMILESCOc1cc(Br)c(O)cc1Cl
InChIInChI=1S/C7H6BrClO2/c1-11-7-2-4(8)6(10)3-5(7)9/h2-3,10H,1H3
InChIKeyGXLLFLVFSKBTKH-UHFFFAOYSA-N
XLogP2.82
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.48
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-2-fluoro-4-methoxyphenol
CID 84655771
4-chloro-5-methoxy-2-methylphenol
CID 21341377
2-tert-butyl-5-chloro-4-methoxyphenol
CID 134599266
1,4-dibromo-2-chloro-5-methoxybenzene
CID 50997851
4-chloro-2-fluoro-5-methoxyphenol
CID 91801475
5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol
CID 117291172
2-(2-bromo-4-chloro-5-methoxyphenyl)acetic acid
CID 84811630
2-bromo-4-chloro-5-methoxybenzamide
CID 68605828
2-bromo-4-methoxy-5-(3-methoxypropoxy)phenol
CID 139466159
5-chloro-2-(1-hydroxypropan-2-yl)-4-methoxyphenol
CID 68794132
2-(1-aminocyclopropyl)-5-chloro-4-methoxyphenol
CID 84783043
1-bromo-4-chloro-2-fluoro-5-methoxybenzene;4-chloro-2-fluoro-5-methoxyaniline
CID 158676801

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-chloro-4-methoxyphenol?
The IUPAC name of 2-bromo-5-chloro-4-methoxyphenol (CID 84700319) is 2-bromo-5-chloro-4-methoxyphenol.
What is the SMILES notation for 2-bromo-5-chloro-4-methoxyphenol?
The canonical SMILES for 2-bromo-5-chloro-4-methoxyphenol is COc1cc(Br)c(O)cc1Cl.
What is the InChIKey of 2-bromo-5-chloro-4-methoxyphenol?
The InChIKey is GXLLFLVFSKBTKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrClO2/c1-11-7-2-4(8)6(10)3-5(7)9/h2-3,10H,1H3.
What are the key properties of 2-bromo-5-chloro-4-methoxyphenol?
2-bromo-5-chloro-4-methoxyphenol has a molecular weight of 237.48 g/mol, XLogP of 2.82, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-chloro-4-methoxyphenol is sourced from PubChem (CID 84700319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).