2,6-Difluoro-4-methoxybenzoic acid

• CAS: 123843-65-2
• Catalog Number: ACM123843652
• Category: Aryl Fluorinated Building Blocks
• Molecular Weight: 188.13
• Molecular Formula: C₈H₆F₂O₃
• Synonyms: MolPort-000-166-084, JRD-1441, 2,6-Difluoro-4-methoxybenzoic acid, 2,6-difluoro-4-methoxy-benzoic Acid, CID2778228, 123843-65-2
• IUPAC Name: 2,6-difluoro-4-methoxybenzoic acid
• Canonical SMILES: COC1=CC(=C(C(=C1)F)C(=O)O)F
• InChI Key: LGHVYSAINQRZJQ-UHFFFAOYSA-N
• Boiling Point: 232ºC at 760mmHg
• Melting Point: 184-185ºC
• Flash Point: 94.1ºC
• Density: 1.399g/cm³
• Exact Mass: 188.02900
• Hazard Statements: H302-H315-H318-H335
• H-Bond Acceptor: 5
• H-Bond Donor: 1
• Safety Description: S26-S36-S37
• Symbol: GHS05

Custom Q&A

What is the molecular formula of 2,6-Difluoro-4-methoxybenzoic acid?

The molecular formula of 2,6-Difluoro-4-methoxybenzoic acid is C8H6F2O3.

When was 2,6-Difluoro-4-methoxybenzoic acid first created?

2,6-Difluoro-4-methoxybenzoic acid was first created on July 19, 2005.

What is the molecular weight of 2,6-Difluoro-4-methoxybenzoic acid?

The molecular weight of 2,6-Difluoro-4-methoxybenzoic acid is 188.13 g/mol.

What is the IUPAC name of 2,6-Difluoro-4-methoxybenzoic acid?

The IUPAC name of 2,6-Difluoro-4-methoxybenzoic acid is 2,6-difluoro-4-methoxybenzoic acid.

What is the InChIKey of 2,6-Difluoro-4-methoxybenzoic acid?

The InChIKey of 2,6-Difluoro-4-methoxybenzoic acid is LGHVYSAINQRZJQ-UHFFFAOYSA-N.

What is the canonical SMILES of 2,6-Difluoro-4-methoxybenzoic acid?

The canonical SMILES of 2,6-Difluoro-4-methoxybenzoic acid is COC1=CC(=C(C(=C1)F)C(=O)O)F.

How many hydrogen bond acceptor counts does 2,6-Difluoro-4-methoxybenzoic acid have?

2,6-Difluoro-4-methoxybenzoic acid has 5 hydrogen bond acceptor counts.

Is 2,6-Difluoro-4-methoxybenzoic acid considered canonicalized?

Yes, 2,6-Difluoro-4-methoxybenzoic acid is considered canonicalized.

What is the topological polar surface area of 2,6-Difluoro-4-methoxybenzoic acid?

The topological polar surface area of 2,6-Difluoro-4-methoxybenzoic acid is 46.5 Ų.

How many rotatable bond counts does 2,6-Difluoro-4-methoxybenzoic acid have?

2,6-Difluoro-4-methoxybenzoic acid has 2 rotatable bond counts.