2,5-dichloro-4-(3-ethoxyphenyl)phenol

C14H12Cl2O2 — CID 107663392

IUPAC2,5-dichloro-4-(3-ethoxyphenyl)phenol
SMILESCCOc1cccc(-c2cc(Cl)c(O)cc2Cl)c1
InChIInChI=1S/C14H12Cl2O2/c1-2-18-10-5-3-4-9(6-10)11-7-13(16)14(17)8-12(11)15/h3-8,17H,2H2,1H3
InChIKeyBXPSAHQHKCSJNO-UHFFFAOYSA-N
MW283.15 g/mol
LogP4.76
Rot. Bonds3

About 2,5-dichloro-4-(3-ethoxyphenyl)phenol

2,5-dichloro-4-(3-ethoxyphenyl)phenol (PubChem CID 107663392) has the molecular formula C14H12Cl2O2 and a molecular weight of 283.15 g/mol. Its IUPAC name is 2,5-dichloro-4-(3-ethoxyphenyl)phenol.

Molecular Properties

Compound Name2,5-dichloro-4-(3-ethoxyphenyl)phenol
PubChem CID107663392
Molecular FormulaC14H12Cl2O2
Molecular Weight283.15 g/mol
Exact Mass282.02
IUPAC Name2,5-dichloro-4-(3-ethoxyphenyl)phenol
SMILESCCOc1cccc(-c2cc(Cl)c(O)cc2Cl)c1
InChIInChI=1S/C14H12Cl2O2/c1-2-18-10-5-3-4-9(6-10)11-7-13(16)14(17)8-12(11)15/h3-8,17H,2H2,1H3
InChIKeyBXPSAHQHKCSJNO-UHFFFAOYSA-N
XLogP4.76
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.15
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-ethoxyphenyl)-6-methoxyphenol
CID 83130790
CID 88533014
CID 88533014
2-(3-ethoxyphenyl)aniline
CID 57482711
2-[3,5-dichloro-4-[3-(3-ethoxyphenyl)-4-hydroxyphenoxy]phenyl]acetic acid
CID 69038710
2,5-dichloro-4-(5-propoxy-3-pyridinyl)phenol
CID 107663404
6-ethoxy-2-hydroxycyclohepta-2,4,6-trien-1-one
CID 101076460
3,5-dichloro-6-(3-ethoxyphenyl)-N-ethylpyridin-2-amine
CID 102753675
6-chloro-3-(3-ethoxyphenyl)chromen-4-one
CID 24720651
4-(2-chloro-4-ethoxyphenyl)-2-hydroxybenzonitrile
CID 53220179
2-[3-(2-amino-5-chloro-4-pyridinyl)phenoxy]-N-methylacetamide;propane
CID 171659471
3-(3-ethoxyphenyl)-2-methylbenzoic acid
CID 53226301
5-chloro-3-(3-ethoxyphenyl)-1,2,4-oxadiazole
CID 60984808

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-4-(3-ethoxyphenyl)phenol?
The IUPAC name of 2,5-dichloro-4-(3-ethoxyphenyl)phenol (CID 107663392) is 2,5-dichloro-4-(3-ethoxyphenyl)phenol.
What is the SMILES notation for 2,5-dichloro-4-(3-ethoxyphenyl)phenol?
The canonical SMILES for 2,5-dichloro-4-(3-ethoxyphenyl)phenol is CCOc1cccc(-c2cc(Cl)c(O)cc2Cl)c1.
What is the InChIKey of 2,5-dichloro-4-(3-ethoxyphenyl)phenol?
The InChIKey is BXPSAHQHKCSJNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2O2/c1-2-18-10-5-3-4-9(6-10)11-7-13(16)14(17)8-12(11)15/h3-8,17H,2H2,1H3.
What are the key properties of 2,5-dichloro-4-(3-ethoxyphenyl)phenol?
2,5-dichloro-4-(3-ethoxyphenyl)phenol has a molecular weight of 283.15 g/mol, XLogP of 4.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-4-(3-ethoxyphenyl)phenol is sourced from PubChem (CID 107663392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).