2-fluoro-4-(2,4,5-trimethylphenyl)phenol

C15H15FO — CID 83130451

IUPAC2-fluoro-4-(2,4,5-trimethylphenyl)phenol
SMILESCc1cc(C)c(-c2ccc(O)c(F)c2)cc1C
InChIInChI=1S/C15H15FO/c1-9-6-11(3)13(7-10(9)2)12-4-5-15(17)14(16)8-12/h4-8,17H,1-3H3
InChIKeyNNEODALZQDWYMJ-UHFFFAOYSA-N
MW230.28 g/mol
LogP4.12
Rot. Bonds1

About 2-fluoro-4-(2,4,5-trimethylphenyl)phenol

2-fluoro-4-(2,4,5-trimethylphenyl)phenol (PubChem CID 83130451) has the molecular formula C15H15FO and a molecular weight of 230.28 g/mol. Its IUPAC name is 2-fluoro-4-(2,4,5-trimethylphenyl)phenol.

Molecular Properties

Compound Name2-fluoro-4-(2,4,5-trimethylphenyl)phenol
PubChem CID83130451
Molecular FormulaC15H15FO
Molecular Weight230.28 g/mol
Exact Mass230.11
IUPAC Name2-fluoro-4-(2,4,5-trimethylphenyl)phenol
SMILESCc1cc(C)c(-c2ccc(O)c(F)c2)cc1C
InChIInChI=1S/C15H15FO/c1-9-6-11(3)13(7-10(9)2)12-4-5-15(17)14(16)8-12/h4-8,17H,1-3H3
InChIKeyNNEODALZQDWYMJ-UHFFFAOYSA-N
XLogP4.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.28
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-fluoro-4-(2,4,5-trimethylphenyl)phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-(2,4,5-trimethylphenyl)phenol?
The IUPAC name of 2-fluoro-4-(2,4,5-trimethylphenyl)phenol (CID 83130451) is 2-fluoro-4-(2,4,5-trimethylphenyl)phenol.
What is the SMILES notation for 2-fluoro-4-(2,4,5-trimethylphenyl)phenol?
The canonical SMILES for 2-fluoro-4-(2,4,5-trimethylphenyl)phenol is Cc1cc(C)c(-c2ccc(O)c(F)c2)cc1C.
What is the InChIKey of 2-fluoro-4-(2,4,5-trimethylphenyl)phenol?
The InChIKey is NNEODALZQDWYMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FO/c1-9-6-11(3)13(7-10(9)2)12-4-5-15(17)14(16)8-12/h4-8,17H,1-3H3.
What are the key properties of 2-fluoro-4-(2,4,5-trimethylphenyl)phenol?
2-fluoro-4-(2,4,5-trimethylphenyl)phenol has a molecular weight of 230.28 g/mol, XLogP of 4.12, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-(2,4,5-trimethylphenyl)phenol is sourced from PubChem (CID 83130451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).