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CAS Number: 1239964-17-0
tert-butyl 3,5-difluoro-4-(hydroxymethyl)benzoate

Structure

tert-butyl 3,5-difluoro-4-(hydroxymethyl)benzoate
Name: tert-butyl 3,5-difluoro-4-(hydroxymethyl)benzoate
Synonyms:
General Information
Product Number: 1239964170

CAS Registry Number 1239964-17-0
Name:
Benzoic acid, 3,​5-​difluoro-​4-​(hydroxymethyl)​-​, 1,​1-​dimethylethyl ester

 

Chemical Formula: C12H14F2O3
Exact Mass: 244.09
Molecular Weight: 244.23
m/z: 244.09 (100.0%), 245.09 (13.0%), 246.10 (1.4%)

 

InChI:InChI=1S/C12H14F2O3/c1-12(2,3)17-11(16)7-4-9(13)8(6-15)10(14)5-7/h4-5,15H,6H2,1-3H3

InChI Key:UQXHOULFCLJBCV-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C)OC(=O)C1=CC(=C(C(=C1)F)CO)F

Specification

98%

References

PCT Int. Appl. (2014), WO 2014175330 A1 20141030. 

PCT Int. Appl. (2011), WO 2011071565 A1 20110616. 

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