Methyl 2-bromo-6-chlorobenzoate

• CAS: 685892-23-3
• Catalog Number: ACM685892233
• Category: Bromine Series
• Molecular Weight: 249.489040 [g/mol]
• Molecular Formula: C8H6BrClO2
• Synonyms: methyl 2-bromo-6-chlorobenzoate, 685892-23-3, Methyl-2-bromo-6-chlorobenzoate, ZINC02511080, PubChem12094, AC1MC1AT, SureCN852447, ACMC-209o44, methyl2-bromo-6-chlorobenzoate, CTK6I8637, methyl-2-bromo-6-chloro benzoate, MolPort-000-157-131, ANW-35522, AKOS004115261, AG-B-26940, AM83025, AS03619, MB02960, RP28866, AK-61908
• IUPAC Name: methyl 2-bromo-6-chlorobenzoate
• SMILES: COC(=O)C1=C(C=CC=C1Br)Cl
• InChI Key: XSNZTSBNXMQBRI-UHFFFAOYSA-N
• Exact Mass: 247.92400
• H-Bond Acceptor: 2
• H-Bond Donor: 0

Custom Q&A

What is the molecular formula of Methyl 2-bromo-6-chlorobenzoate?

The molecular formula of Methyl 2-bromo-6-chlorobenzoate is C8H6BrClO2.

When was Methyl 2-bromo-6-chlorobenzoate created in PubChem?

Methyl 2-bromo-6-chlorobenzoate was created in PubChem on July 19, 2005.

What is the IUPAC Name of Methyl 2-bromo-6-chlorobenzoate?

The IUPAC Name of Methyl 2-bromo-6-chlorobenzoate is methyl 2-bromo-6-chlorobenzoate.

What is the InChIKey of Methyl 2-bromo-6-chlorobenzoate?

The InChIKey of Methyl 2-bromo-6-chlorobenzoate is XSNZTSBNXMQBRI-UHFFFAOYSA-N.

What is the molecular weight of Methyl 2-bromo-6-chlorobenzoate?

The molecular weight of Methyl 2-bromo-6-chlorobenzoate is 249.49 g/mol.

What is the Canonical SMILES of Methyl 2-bromo-6-chlorobenzoate?

The Canonical SMILES of Methyl 2-bromo-6-chlorobenzoate is COC(=O)C1=C(C=CC=C1Br)Cl.

What is the CAS number of Methyl 2-bromo-6-chlorobenzoate?

The CAS number of Methyl 2-bromo-6-chlorobenzoate is 685892-23-3.

How many hydrogen bond donor counts does Methyl 2-bromo-6-chlorobenzoate have?

Methyl 2-bromo-6-chlorobenzoate has 0 hydrogen bond donor count.

What is the topological polar surface area of Methyl 2-bromo-6-chlorobenzoate?

The topological polar surface area of Methyl 2-bromo-6-chlorobenzoate is 26.3Ų.

Is Methyl 2-bromo-6-chlorobenzoate a canonical compound?

Yes, Methyl 2-bromo-6-chlorobenzoate is a canonical compound according to PubChem.