1,2-difluoro-4-methoxybenzene

C7H6F2O — CID 568250

IUPAC1,2-difluoro-4-methoxybenzene
SMILESCOc1ccc(F)c(F)c1
InChIInChI=1S/C7H6F2O/c1-10-5-2-3-6(8)7(9)4-5/h2-4H,1H3
InChIKeyDSEVNUCNUTYYHW-UHFFFAOYSA-N
MW144.12 g/mol
LogP1.97
Rot. Bonds1

About 1,2-difluoro-4-methoxybenzene

1,2-difluoro-4-methoxybenzene (PubChem CID 568250) has the molecular formula C7H6F2O and a molecular weight of 144.12 g/mol. Its IUPAC name is 1,2-difluoro-4-methoxybenzene.

Molecular Properties

Compound Name1,2-difluoro-4-methoxybenzene
PubChem CID568250
Molecular FormulaC7H6F2O
Molecular Weight144.12 g/mol
Exact Mass144.04
IUPAC Name1,2-difluoro-4-methoxybenzene
SMILESCOc1ccc(F)c(F)c1
InChIInChI=1S/C7H6F2O/c1-10-5-2-3-6(8)7(9)4-5/h2-4H,1H3
InChIKeyDSEVNUCNUTYYHW-UHFFFAOYSA-N
XLogP1.97
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.12
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1,2-difluoro-4-methoxybenzene 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 1,2-difluoro-4-methoxybenzene?
The IUPAC name of 1,2-difluoro-4-methoxybenzene (CID 568250) is 1,2-difluoro-4-methoxybenzene.
What is the SMILES notation for 1,2-difluoro-4-methoxybenzene?
The canonical SMILES for 1,2-difluoro-4-methoxybenzene is COc1ccc(F)c(F)c1.
What is the InChIKey of 1,2-difluoro-4-methoxybenzene?
The InChIKey is DSEVNUCNUTYYHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F2O/c1-10-5-2-3-6(8)7(9)4-5/h2-4H,1H3.
What are the key properties of 1,2-difluoro-4-methoxybenzene?
1,2-difluoro-4-methoxybenzene has a molecular weight of 144.12 g/mol, XLogP of 1.97, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-difluoro-4-methoxybenzene is sourced from PubChem (CID 568250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).