2-fluoro-4-hydroxybenzonitrile

C7H4FNO — CID 2734675

IUPAC2-fluoro-4-hydroxybenzonitrile
SMILESN#Cc1ccc(O)cc1F
InChIInChI=1S/C7H4FNO/c8-7-3-6(10)2-1-5(7)4-9/h1-3,10H
InChIKeyREIVHYDACHXPNH-UHFFFAOYSA-N
MW137.11 g/mol
LogP1.40
Rot. Bonds

About 2-fluoro-4-hydroxybenzonitrile

2-fluoro-4-hydroxybenzonitrile (PubChem CID 2734675) has the molecular formula C7H4FNO and a molecular weight of 137.11 g/mol. Its IUPAC name is 2-fluoro-4-hydroxybenzonitrile.

Molecular Properties

Compound Name2-fluoro-4-hydroxybenzonitrile
PubChem CID2734675
Molecular FormulaC7H4FNO
Molecular Weight137.11 g/mol
Exact Mass137.03
IUPAC Name2-fluoro-4-hydroxybenzonitrile
SMILESN#Cc1ccc(O)cc1F
InChIInChI=1S/C7H4FNO/c8-7-3-6(10)2-1-5(7)4-9/h1-3,10H
InChIKeyREIVHYDACHXPNH-UHFFFAOYSA-N
XLogP1.40
TPSA44.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.11
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-hydroxybenzonitrile?
The IUPAC name of 2-fluoro-4-hydroxybenzonitrile (CID 2734675) is 2-fluoro-4-hydroxybenzonitrile.
What is the SMILES notation for 2-fluoro-4-hydroxybenzonitrile?
The canonical SMILES for 2-fluoro-4-hydroxybenzonitrile is N#Cc1ccc(O)cc1F.
What is the InChIKey of 2-fluoro-4-hydroxybenzonitrile?
The InChIKey is REIVHYDACHXPNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4FNO/c8-7-3-6(10)2-1-5(7)4-9/h1-3,10H.
What are the key properties of 2-fluoro-4-hydroxybenzonitrile?
2-fluoro-4-hydroxybenzonitrile has a molecular weight of 137.11 g/mol, XLogP of 1.40, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-hydroxybenzonitrile is sourced from PubChem (CID 2734675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).