2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol

C10H12F2O3 — CID 117310551

IUPAC2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol
SMILESCOc1cc(O)c(F)c(CC(C)O)c1F
InChIInChI=1S/C10H12F2O3/c1-5(13)3-6-9(11)7(14)4-8(15-2)10(6)12/h4-5,13-14H,3H2,1-2H3
InChIKeyMKRHQILYBKCZOH-UHFFFAOYSA-N
MW218.20 g/mol
LogP1.60
Rot. Bonds3

About 2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol

2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol (PubChem CID 117310551) has the molecular formula C10H12F2O3 and a molecular weight of 218.20 g/mol. Its IUPAC name is 2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol.

Molecular Properties

Compound Name2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol
PubChem CID117310551
Molecular FormulaC10H12F2O3
Molecular Weight218.20 g/mol
Exact Mass218.08
IUPAC Name2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol
SMILESCOc1cc(O)c(F)c(CC(C)O)c1F
InChIInChI=1S/C10H12F2O3/c1-5(13)3-6-9(11)7(14)4-8(15-2)10(6)12/h4-5,13-14H,3H2,1-2H3
InChIKeyMKRHQILYBKCZOH-UHFFFAOYSA-N
XLogP1.60
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.20
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol with MolForge

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

Launch Full Analysis

Related Compounds

5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol
CID 117289277
2-bromo-4-fluoro-3-(2-hydroxypropyl)-6-methoxyphenol
CID 117447325
1-(3-chloro-4-fluoro-5-methoxyphenyl)propan-2-ol
CID 117311647
2-(2-fluoro-3-hydroxy-5,6-dimethoxyphenyl)acetic acid
CID 117331962
5-(2-hydroxypropyl)-2,4-dimethoxyphenol
CID 117303005
5-bromo-4-(2-hydroxypropyl)-2-methoxyphenol
CID 117406460
1-(2-fluoro-6-methoxy-3-phenylmethoxyphenyl)propan-2-ol
CID 117469072
1-(2,4-difluoro-5-methoxyphenyl)propan-2-ol
CID 117290712
1-(4-methoxy-2,3,6-trimethylphenyl)propan-2-ol
CID 117114494
2-fluoro-5-methoxy-3,4-dimethylphenol
CID 10607234
3-chloro-2-(2-hydroxypropyl)-5,6-dimethoxyphenol
CID 117369237
(1S)-1-(3,4-difluoro-5-methoxyphenyl)ethanol
CID 97293354

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol?
The IUPAC name of 2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol (CID 117310551) is 2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol.
What is the SMILES notation for 2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol?
The canonical SMILES for 2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol is COc1cc(O)c(F)c(CC(C)O)c1F.
What is the InChIKey of 2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol?
The InChIKey is MKRHQILYBKCZOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2O3/c1-5(13)3-6-9(11)7(14)4-8(15-2)10(6)12/h4-5,13-14H,3H2,1-2H3.
What are the key properties of 2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol?
2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol has a molecular weight of 218.20 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol is sourced from PubChem (CID 117310551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).