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Structure

Methyl 2-bromo-5-chlorobenzoate

CAS
27007-53-0
Catalog Number
ACM27007530
Category
Bromine Series
Molecular Weight
249.49
Molecular Formula
C8H6BrClO2

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What is the molecular formula of Methyl 2-bromo-5-chlorobenzoate?

The molecular formula of Methyl 2-bromo-5-chlorobenzoate is C8H6BrClO2.

What is the molecular weight of Methyl 2-bromo-5-chlorobenzoate?

The molecular weight of Methyl 2-bromo-5-chlorobenzoate is 249.49 g/mol.

What is the IUPAC name of Methyl 2-bromo-5-chlorobenzoate?

The IUPAC name of Methyl 2-bromo-5-chlorobenzoate is methyl 2-bromo-5-chlorobenzoate.

What is the InChI of Methyl 2-bromo-5-chlorobenzoate?

The InChI of Methyl 2-bromo-5-chlorobenzoate is InChI=1S/C8H6BrClO2/c1-12-8(11)6-4-5(10)2-3-7(6)9/h2-4H,1H3.

What is the InChIKey of Methyl 2-bromo-5-chlorobenzoate?

The InChIKey of Methyl 2-bromo-5-chlorobenzoate is BIECSXCXIXHDBC-UHFFFAOYSA-N.

What is the canonical SMILES of Methyl 2-bromo-5-chlorobenzoate?

The canonical SMILES of Methyl 2-bromo-5-chlorobenzoate is COC(=O)C1=C(C=CC(=C1)Cl)Br.

What other identifiers are associated with Methyl 2-bromo-5-chlorobenzoate?

The other identifiers associated with Methyl 2-bromo-5-chlorobenzoate include CAS number: 27007-53-0, European Community (EC) Number: 640-830-6, DSSTox Substance ID: DTXSID70299702, Nikkaji Number: J340.470F, NSC Number: 132246, and Wikidata: Q72488442.

What is the XLogP3 value of Methyl 2-bromo-5-chlorobenzoate?

The XLogP3 value of Methyl 2-bromo-5-chlorobenzoate is 4.1.

Is Methyl 2-bromo-5-chlorobenzoate a canonicalized compound?

Yes, Methyl 2-bromo-5-chlorobenzoate is a canonicalized compound.

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