3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol

C13H11FO2 — CID 53218862

IUPAC3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol
SMILESCc1cc(O)cc(-c2cc(O)cc(F)c2)c1
InChIInChI=1S/C13H11FO2/c1-8-2-9(5-12(15)3-8)10-4-11(14)7-13(16)6-10/h2-7,15-16H,1H3
InChIKeyQAJQZDJYVREHBA-UHFFFAOYSA-N
MW218.23 g/mol
LogP3.21
Rot. Bonds1

About 3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol

3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol (PubChem CID 53218862) has the molecular formula C13H11FO2 and a molecular weight of 218.23 g/mol. Its IUPAC name is 3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol.

Molecular Properties

Compound Name3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol
PubChem CID53218862
Molecular FormulaC13H11FO2
Molecular Weight218.23 g/mol
Exact Mass218.07
IUPAC Name3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol
SMILESCc1cc(O)cc(-c2cc(O)cc(F)c2)c1
InChIInChI=1S/C13H11FO2/c1-8-2-9(5-12(15)3-8)10-4-11(14)7-13(16)6-10/h2-7,15-16H,1H3
InChIKeyQAJQZDJYVREHBA-UHFFFAOYSA-N
XLogP3.21
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.23
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-difluorophenol
CID 159284632
3-(4-fluoro-3-methoxyphenyl)-5-methylphenol
CID 53218961
CID 175809990
CID 175809990
1-fluoro-3-(3-fluorophenyl)-5-methylbenzene
CID 46313952
3-chloro-5-(3-chloro-5-fluorophenyl)phenol
CID 53221372
3-fluoro-5-(2-methoxy-4-pyridinyl)phenol
CID 83130700
3-fluoro-5-(3-methylthiophen-2-yl)phenol
CID 53445676
3-fluoro-5-(1-methylpyrazol-4-yl)phenol
CID 83130417
2-(3-fluoro-5-hydroxyphenyl)-5-methylbenzoic acid
CID 53225648
3-fluoro-5-[5-(3-fluoro-5-hydroxyphenyl)thiophen-2-yl]phenol
CID 71624464
carbanide;3,5-dimethylphenol;titanium(2+)
CID 174659955
4-(3-hydroxy-5-methylphenyl)benzoic acid
CID 53218919

Frequently Asked Questions

What is the IUPAC name of 3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol?
The IUPAC name of 3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol (CID 53218862) is 3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol.
What is the SMILES notation for 3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol?
The canonical SMILES for 3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol is Cc1cc(O)cc(-c2cc(O)cc(F)c2)c1.
What is the InChIKey of 3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol?
The InChIKey is QAJQZDJYVREHBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FO2/c1-8-2-9(5-12(15)3-8)10-4-11(14)7-13(16)6-10/h2-7,15-16H,1H3.
What are the key properties of 3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol?
3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol has a molecular weight of 218.23 g/mol, XLogP of 3.21, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluoro-5-hydroxyphenyl)-5-methylphenol is sourced from PubChem (CID 53218862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).