3-fluoro-4-(4-phenylmethoxyphenyl)phenol

C19H15FO2 — CID 53219756

IUPAC3-fluoro-4-(4-phenylmethoxyphenyl)phenol
SMILESOc1ccc(-c2ccc(OCc3ccccc3)cc2)c(F)c1
InChIInChI=1S/C19H15FO2/c20-19-12-16(21)8-11-18(19)15-6-9-17(10-7-15)22-13-14-4-2-1-3-5-14/h1-12,21H,13H2
InChIKeyMGXSUZPIPHJTCG-UHFFFAOYSA-N
MW294.32 g/mol
LogP4.78
Rot. Bonds4

About 3-fluoro-4-(4-phenylmethoxyphenyl)phenol

3-fluoro-4-(4-phenylmethoxyphenyl)phenol (PubChem CID 53219756) has the molecular formula C19H15FO2 and a molecular weight of 294.32 g/mol. Its IUPAC name is 3-fluoro-4-(4-phenylmethoxyphenyl)phenol.

Molecular Properties

Compound Name3-fluoro-4-(4-phenylmethoxyphenyl)phenol
PubChem CID53219756
Molecular FormulaC19H15FO2
Molecular Weight294.32 g/mol
Exact Mass294.11
IUPAC Name3-fluoro-4-(4-phenylmethoxyphenyl)phenol
SMILESOc1ccc(-c2ccc(OCc3ccccc3)cc2)c(F)c1
InChIInChI=1S/C19H15FO2/c20-19-12-16(21)8-11-18(19)15-6-9-17(10-7-15)22-13-14-4-2-1-3-5-14/h1-12,21H,13H2
InChIKeyMGXSUZPIPHJTCG-UHFFFAOYSA-N
XLogP4.78
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.32
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-bromophenyl)-2-fluoro-4-phenylmethoxybenzene
CID 54462897
2-phenyl-5-phenylmethoxyphenol
CID 123808909
3-fluoro-4-(4-propoxyphenyl)phenol
CID 83130933
1-bromo-2-fluoro-4-[2-fluoro-4-(2-fluoro-4-phenylmethoxyphenyl)phenyl]benzene
CID 54361131
[3-(difluoromethyl)-4-(4-phenylmethoxyphenyl)phenyl]methanol
CID 170919037
3-fluoro-5-(4-phenylmethoxyphenyl)phenol
CID 53219757
3-fluoro-4-(4-octoxyphenyl)phenol
CID 19430943
2-fluoro-4-[(3-methylphenyl)methoxy]-1-phenylbenzene
CID 3743776
[3,5-difluoro-4-(4-phenylmethoxyphenyl)phenyl]methanol;ethanol
CID 70007811
1,3-diphenylbenzene;4-phenylmethoxyphenol
CID 70041760
2-fluoro-4-(4-hydroxyphenyl)benzonitrile;2-fluoro-4-(4-phenylmethoxyphenyl)benzonitrile
CID 23173787
4-(2-nitro-4-phenylmethoxyphenyl)phenol
CID 66934266

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-(4-phenylmethoxyphenyl)phenol?
The IUPAC name of 3-fluoro-4-(4-phenylmethoxyphenyl)phenol (CID 53219756) is 3-fluoro-4-(4-phenylmethoxyphenyl)phenol.
What is the SMILES notation for 3-fluoro-4-(4-phenylmethoxyphenyl)phenol?
The canonical SMILES for 3-fluoro-4-(4-phenylmethoxyphenyl)phenol is Oc1ccc(-c2ccc(OCc3ccccc3)cc2)c(F)c1.
What is the InChIKey of 3-fluoro-4-(4-phenylmethoxyphenyl)phenol?
The InChIKey is MGXSUZPIPHJTCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FO2/c20-19-12-16(21)8-11-18(19)15-6-9-17(10-7-15)22-13-14-4-2-1-3-5-14/h1-12,21H,13H2.
What are the key properties of 3-fluoro-4-(4-phenylmethoxyphenyl)phenol?
3-fluoro-4-(4-phenylmethoxyphenyl)phenol has a molecular weight of 294.32 g/mol, XLogP of 4.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-(4-phenylmethoxyphenyl)phenol is sourced from PubChem (CID 53219756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).