4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol

C13H10F2O2 — CID 22669988

IUPAC4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol
SMILESOCc1cc(F)c(-c2ccc(O)cc2)c(F)c1
InChIInChI=1S/C13H10F2O2/c14-11-5-8(7-16)6-12(15)13(11)9-1-3-10(17)4-2-9/h1-6,16-17H,7H2
InChIKeyFBGCSAGXULENAX-UHFFFAOYSA-N
MW236.22 g/mol
LogP2.83
Rot. Bonds2

About 4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol

4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol (PubChem CID 22669988) has the molecular formula C13H10F2O2 and a molecular weight of 236.22 g/mol. Its IUPAC name is 4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol.

Molecular Properties

Compound Name4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol
PubChem CID22669988
Molecular FormulaC13H10F2O2
Molecular Weight236.22 g/mol
Exact Mass236.06
IUPAC Name4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol
SMILESOCc1cc(F)c(-c2ccc(O)cc2)c(F)c1
InChIInChI=1S/C13H10F2O2/c14-11-5-8(7-16)6-12(15)13(11)9-1-3-10(17)4-2-9/h1-6,16-17H,7H2
InChIKeyFBGCSAGXULENAX-UHFFFAOYSA-N
XLogP2.83
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.22
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[3,5-difluoro-4-(4-phenylmethoxyphenyl)phenyl]methanol;ethanol
CID 70007811
4-[4-(hydroxymethyl)-2,6-dimethoxyphenyl]phenol
CID 22669970
4-(2,6-difluorophenyl)phenol
CID 53218545
[3,5-dichloro-4-(4-fluorophenyl)phenyl]methanol
CID 66764611
4-(4-amino-2,3,6-trifluorophenyl)phenol
CID 174494106
4-(2-fluoro-4-propylphenyl)phenol
CID 139457311
4-(hydroxymethyl)phenol;hydrate
CID 141133894
(3,4-difluorophenyl)methanol
CID 522833
4-[2,4-bis(hydroxymethyl)phenyl]phenol
CID 70444376
[4-fluoro-3-(4-fluorophenyl)phenyl]methanol
CID 46312404
[4-(3,4,5-trifluorophenyl)phenyl]methanol
CID 57062577
4-(4-chloro-2-fluorophenyl)phenol
CID 83128689

Frequently Asked Questions

What is the IUPAC name of 4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol?
The IUPAC name of 4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol (CID 22669988) is 4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol.
What is the SMILES notation for 4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol?
The canonical SMILES for 4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol is OCc1cc(F)c(-c2ccc(O)cc2)c(F)c1.
What is the InChIKey of 4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol?
The InChIKey is FBGCSAGXULENAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F2O2/c14-11-5-8(7-16)6-12(15)13(11)9-1-3-10(17)4-2-9/h1-6,16-17H,7H2.
What are the key properties of 4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol?
4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol has a molecular weight of 236.22 g/mol, XLogP of 2.83, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2,6-difluoro-4-(hydroxymethyl)phenyl]phenol is sourced from PubChem (CID 22669988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).