CAS
947534-37-4 Purity
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947534-37-4 Purity
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2-(3-Bromo-phenyl)-[1,3]oxathiane
CAS
947534-46-5
Catalog Number
ACM947534465
Category
Other Products
Molecular Weight
259.16274
Molecular Formula
C10H11BrOS
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Specification
Synonyms
2-(3-Bromo-phenyl)-[1,3]oxathiane
What is the molecular formula of the compound?
The molecular formula of the compound is C10H11BrOS.
What is the molecular weight of the compound?
The molecular weight of the compound is 259.16 g/mol.
When was the compound created?
The compound was created on April 27, 2010.
When was the compound last modified?
The compound was last modified on December 30, 2023.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 2-(3-bromophenyl)-1,3-oxathiane.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C10H11BrOS/c11-9-4-1-3-8(7-9)10-12-5-2-6-13-10/h1,3-4,7,10H,2,5-6H2.
What is the InChIKey of the compound?
The InChIKey of the compound is MEEWQZWPLNYYER-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES of the compound is C1COC(SC1)C2=CC(=CC=C2)Br.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value of the compound is 3.2.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 34.5 Ų.
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