5-Bromo-2-hydroxy-3-(trifluoromethyl)benzaldehyde

• CAS: 251300-30-8
• Catalog Number: ACM251300308
• Category: Bromine Series
• Molecular Weight: 269.0156
• Molecular Formula: C₈H₄BrF₃O₂
• Synonyms: 5-Bromo-3-(trifluoromethyl)salicylaldehyde, 5-Bromo-3-formyl-2-hydroxybenzotrifluoride
• IUPAC Name: 5-bromo-2-hydroxy-3-(trifluoromethyl)benzaldehyde
• Canonical SMILES: C1=C(C=C(C(=C1C(F)(F)F)O)C=O)Br
• InChI Key: NCOPDQCEVBJGNB-UHFFFAOYSA-N
• Exact Mass: 267.93500
• H-Bond Acceptor: 5
• H-Bond Donor: 1

Custom Q&A

What is the molecular formula of 5-Bromo-2-hydroxy-3-(trifluoromethyl)benzaldehyde?

The molecular formula is C8H4BrF3O2.

What is the molecular weight of 5-Bromo-2-hydroxy-3-(trifluoromethyl)benzaldehyde?

The molecular weight is 269.01 g/mol.

What is the IUPAC name of 5-Bromo-2-hydroxy-3-(trifluoromethyl)benzaldehyde?

The IUPAC name is 5-bromo-2-hydroxy-3-(trifluoromethyl)benzaldehyde.

What is the InChI key of 5-Bromo-2-hydroxy-3-(trifluoromethyl)benzaldehyde?

The InChI key is NCOPDQCEVBJGNB-UHFFFAOYSA-N.

What is the canonical SMILES of 5-Bromo-2-hydroxy-3-(trifluoromethyl)benzaldehyde?

The canonical SMILES is C1=C(C=C(C(=C1C=O)O)C(F)(F)F)Br.

What is the CAS number of 5-Bromo-2-hydroxy-3-(trifluoromethyl)benzaldehyde?

The CAS number is 251300-30-8.

What is the XLogP3-AA value of 5-Bromo-2-hydroxy-3-(trifluoromethyl)benzaldehyde?

The XLogP3-AA value is 3.2.

How many hydrogen bond donor counts does 5-Bromo-2-hydroxy-3-(trifluoromethyl)benzaldehyde have?

It has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 5-Bromo-2-hydroxy-3-(trifluoromethyl)benzaldehyde have?

It has 5 hydrogen bond acceptor counts.

How many rotatable bond counts does 5-Bromo-2-hydroxy-3-(trifluoromethyl)benzaldehyde have?

It has 1 rotatable bond count.