4-[3-(fluoromethyl)phenyl]phenol

C13H11FO — CID 174968947

IUPAC4-[3-(fluoromethyl)phenyl]phenol
SMILESOc1ccc(-c2cccc(CF)c2)cc1
InChIInChI=1S/C13H11FO/c14-9-10-2-1-3-12(8-10)11-4-6-13(15)7-5-11/h1-8,15H,9H2
InChIKeyWCLIJPXNWQXQRB-UHFFFAOYSA-N
MW202.23 g/mol
LogP3.53
Rot. Bonds2

About 4-[3-(fluoromethyl)phenyl]phenol

4-[3-(fluoromethyl)phenyl]phenol (PubChem CID 174968947) has the molecular formula C13H11FO and a molecular weight of 202.23 g/mol. Its IUPAC name is 4-[3-(fluoromethyl)phenyl]phenol.

Molecular Properties

Compound Name4-[3-(fluoromethyl)phenyl]phenol
PubChem CID174968947
Molecular FormulaC13H11FO
Molecular Weight202.23 g/mol
Exact Mass202.08
IUPAC Name4-[3-(fluoromethyl)phenyl]phenol
SMILESOc1ccc(-c2cccc(CF)c2)cc1
InChIInChI=1S/C13H11FO/c14-9-10-2-1-3-12(8-10)11-4-6-13(15)7-5-11/h1-8,15H,9H2
InChIKeyWCLIJPXNWQXQRB-UHFFFAOYSA-N
XLogP3.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.23
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(3-benzylphenyl)phenol
CID 101277658
[3-(4-hydroxyphenyl)phenyl]methyl-methanidylazanium
CID 58907470
1,3-bis(fluoromethyl)benzene
CID 23234185
4-[3-(pyrrolidin-1-ylmethyl)phenyl]phenol
CID 139355118
N-[[3-(4-hydroxyphenyl)phenyl]methyl]formamide
CID 144526054
3-(4-hydroxyphenyl)phenol;hydrobromide
CID 153382873
4-[5-[3-(fluoromethyl)phenyl]tetrazol-1-yl]phenol
CID 122501634
3-(4-hydroxyphenyl)phenol;propane
CID 175032185
N-[[3-(4-hydroxyphenyl)phenyl]methyl]acetamide
CID 56704021
[3-(4-hydroxyphenyl)phenyl]methyl dimethyl phosphate
CID 144822987
4-[3-(1,2,4-triazol-1-ylmethyl)phenyl]phenol
CID 23585512
4-[4-[3-(trifluoromethyl)phenyl]phenyl]phenol
CID 142750929

Frequently Asked Questions

What is the IUPAC name of 4-[3-(fluoromethyl)phenyl]phenol?
The IUPAC name of 4-[3-(fluoromethyl)phenyl]phenol (CID 174968947) is 4-[3-(fluoromethyl)phenyl]phenol.
What is the SMILES notation for 4-[3-(fluoromethyl)phenyl]phenol?
The canonical SMILES for 4-[3-(fluoromethyl)phenyl]phenol is Oc1ccc(-c2cccc(CF)c2)cc1.
What is the InChIKey of 4-[3-(fluoromethyl)phenyl]phenol?
The InChIKey is WCLIJPXNWQXQRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FO/c14-9-10-2-1-3-12(8-10)11-4-6-13(15)7-5-11/h1-8,15H,9H2.
What are the key properties of 4-[3-(fluoromethyl)phenyl]phenol?
4-[3-(fluoromethyl)phenyl]phenol has a molecular weight of 202.23 g/mol, XLogP of 3.53, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(fluoromethyl)phenyl]phenol is sourced from PubChem (CID 174968947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).