2-Amino-3,5-dibromo-6-fluorobenzoic acid

• Catalog Number: ACM175135101
• Product Name: 2-Amino-3,5-dibromo-6-fluorobenzoic acid
• CAS: 175135-10-1
• Category: Bromine Series
• Synonyms: 2-AMINO-3,5-DIBROMO-6-FLUOROBENZOIC ACID;3,5-DiBromo-6-fluoroanthranilicacid;2-Amino-3,5-dibromo-6-fluorobenzoic acid 98%;2-Amino-3,5-dibromo-6-fluorobenzoicacid98%
• IUPAC Name: 2-amino-3,5-dibromo-6-fluorobenzoic acid
• Molecular Weight: 312.92
• Molecular Formula: C₇H₄Br₂FNO₂
• Canonical SMILES: C1=C(C(=C(C(=C1Br)F)C(=O)O)N)Br
• InChI Key: DHWCACOUGDPIBD-UHFFFAOYSA-N
• Boiling Point: 355.9ºC at 760 mmHg
• Melting Point: 235ºC
• Flash Point: 169.1ºC
• Density: 2.222g/cm³
• Exact Mass: 310.85900
• Hazard Statements: Xi
• H-Bond Acceptor: 4
• H-Bond Donor: 2
• Safety Description: 22-26-36/37/39

Custom Q&A

What is the molecular formula of the compound?

The molecular formula of the compound is C7H4Br2FNO2.

What is the molecular weight of the compound?

The molecular weight of the compound is 312.92 g/mol.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 2-amino-3,5-dibromo-6-fluorobenzoic acid.

What is the InChI of the compound?

The InChI of the compound is InChI=1S/C7H4Br2FNO2/c8-2-1-3(9)6(11)4(5(2)10)7(12)13/h1H,11H2,(H,12,13).

What is the InChIKey of the compound?

The InChIKey of the compound is DHWCACOUGDPIBD-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES of the compound is C1=C(C(=C(C(=C1Br)F)C(=O)O)N)Br.

What is the CAS number of the compound?

The CAS number of the compound is 175135-10-1.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value of the compound is 2.8.

How many hydrogen bond donor counts does the compound have?

The compound has a hydrogen bond donor count of 2.

How many hydrogen bond acceptor counts does the compound have?

The compound has a hydrogen bond acceptor count of 4.