CAS
908244-04-2 Purity
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908244-04-2 Purity
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Methyl 4-bromo-2-chloro-5-fluorobenzoate
CAS
908248-32-8
Catalog Number
ACM908248328
Category
Other Products
Molecular Weight
267.479503;g/mol
Molecular Formula
C8H5BrClFO2
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Specification
IUPAC Name
methyl4-bromo-2-chloro-5-fluorobenzoate
Canonical SMILES
COC(=O)C1=CC(=C(C=C1Cl)Br)F
InChI Key
STIGMHTZDYRUGA-UHFFFAOYSA-N
Exact Mass
265.91500
What is the molecular formula of Methyl 4-bromo-2-chloro-5-fluorobenzoate?
The molecular formula is C8H5BrClFO2.
When was Methyl 4-bromo-2-chloro-5-fluorobenzoate created and last modified?
It was created on 2009-09-25 and last modified on 2023-12-30.
What is the IUPAC Name of Methyl 4-bromo-2-chloro-5-fluorobenzoate?
The IUPAC Name is methyl 4-bromo-2-chloro-5-fluorobenzoate.
What is the InChIKey of Methyl 4-bromo-2-chloro-5-fluorobenzoate?
The InChIKey is STIGMHTZDYRUGA-UHFFFAOYSA-N.
What is the canonical SMILES representation of Methyl 4-bromo-2-chloro-5-fluorobenzoate?
The canonical SMILES is COC(=O)C1=CC(=C(C=C1Cl)Br)F.
What is the molecular weight of Methyl 4-bromo-2-chloro-5-fluorobenzoate?
The molecular weight is 267.48 g/mol.
How many hydrogen bond acceptors does Methyl 4-bromo-2-chloro-5-fluorobenzoate have?
It has 3 hydrogen bond acceptors.
What is the exact mass of Methyl 4-bromo-2-chloro-5-fluorobenzoate?
The exact mass is 265.91455 g/mol.
How many rotatable bonds does Methyl 4-bromo-2-chloro-5-fluorobenzoate have?
It has 2 rotatable bonds.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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