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CAS Number: 151104-30-2
methyl 2-chloro-5-(methylsulfonyl)benzoate

Structure

methyl 2-chloro-5-(methylsulfonyl)benzoate
Name: methyl 2-chloro-5-(methylsulfonyl)benzoate
Synonyms:
General Information
Product Number: 151104302

CAS Registry Number 151104-30-2
Name:
Benzoic acid, 2-​chloro-​5-​(methylsulfonyl)​-​, methyl ester
2-Chloro-5-(methylsulfonyl)benzoic acid methyl ester
Methyl 2-chloro-5-(methanesulfonyl)benzoate
Methyl 2-chloro-5-methylsulfonylbenzoate

 

Chemical Formula: C9H9ClO4S
Exact Mass: 247.99
Molecular Weight: 248.68
m/z: 247.99 (100.0%), 249.99 (36.6%), 248.99 (10.5%), 250.99 (3.9%), 251.98 (1.4%), 250.00 (1.3%)

 

InChI:InChI=1S/C9H9ClO4S/c1-14-9(11)7-5-6(15(2,12)13)3-4-8(7)10/h3-5H,1-2H3

InChI Key:TWQIUEXLVURDJT-UHFFFAOYSA-N

Canonical SMILES:COC(=O)C1=C(C=CC(=C1)S(=O)(=O)C)Cl

Specification

98%

References

PCT Int. Appl. (2013), WO 2013092893 A1 20130627.

PCT Int. Appl. (2006), WO 2006094840 A1 20060914.                                  

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