5-Bromo-2-hydroxybenzoate

• CAS: 56529-67-0
• Catalog Number: ACM56529670
• Category: Bromine Series
• Molecular Weight: 307.139340 [g/mol]
• Molecular Formula: C₁₄H₁₁BrO₃
• Synonyms: benzyl 5-bromo-2-hydroxybenzoate, 56529-67-0, ZINC05743393, AC1OTCD0, CTK8E2421, SBB068200, AKOS015856320, AK133801, KB-145443, FT-0656417, (phenylmethyl) 5-bromanyl-2-oxidanyl-benzoate, A831075, 5-bromo-2-hydroxybenzoic acid (phenylmethyl) ester, I14-5656
• IUPAC Name: benzyl 5-bromo-2-hydroxybenzoate
• InChI Key: HVRNODKHDGQLGQ-UHFFFAOYSA-N
• Boiling Point: 389.732ºC at 760 mmHg
• Flash Point: 189.504ºC
• Density: 1.516g/cm³
• Exact Mass: 305.98900
• H-Bond Acceptor: 3
• H-Bond Donor: 1

Custom Q&A

What is the molecular formula of 5-Bromo-2-hydroxybenzoate?

The molecular formula of 5-Bromo-2-hydroxybenzoate is C7H4BrO3.

What is the molecular weight of 5-Bromo-2-hydroxybenzoate?

The molecular weight of 5-Bromo-2-hydroxybenzoate is 216.01 g/mol.

What is the IUPAC name of 5-Bromo-2-hydroxybenzoate?

The IUPAC name of 5-Bromo-2-hydroxybenzoate is 4-bromo-2-carboxyphenolate.

What is the InChI of 5-Bromo-2-hydroxybenzoate?

The InChI of 5-Bromo-2-hydroxybenzoate is InChI=1S/C7H5BrO3/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,9H,(H,10,11)/p-1.

What is the InChIKey of 5-Bromo-2-hydroxybenzoate?

The InChIKey of 5-Bromo-2-hydroxybenzoate is IEJOONSLOGAXNO-UHFFFAOYSA-M.

What is the Canonical SMILES of 5-Bromo-2-hydroxybenzoate?

The Canonical SMILES of 5-Bromo-2-hydroxybenzoate is C1=CC(=C(C=C1Br)C(=O)O)[O-].

What is the XLogP3 value of 5-Bromo-2-hydroxybenzoate?

The XLogP3 value of 5-Bromo-2-hydroxybenzoate is 3.9.

How many hydrogen bond donor atoms are present in 5-Bromo-2-hydroxybenzoate?

There is 1 hydrogen bond donor atom present in 5-Bromo-2-hydroxybenzoate.

How many hydrogen bond acceptor atoms are present in 5-Bromo-2-hydroxybenzoate?

There are 3 hydrogen bond acceptor atoms present in 5-Bromo-2-hydroxybenzoate.

How many rotatable bonds are present in 5-Bromo-2-hydroxybenzoate?

There is 1 rotatable bond present in 5-Bromo-2-hydroxybenzoate.