3,4-Bis(difluoromethoxy)benzoic acid
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3,4-Bis(difluoromethoxy)benzoic acid
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CAS No:
162401-60-7
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Formula:
C9H6F4O4
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Chemical Name:
3,4-Bis(difluoromethoxy)benzoic acid
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Synonyms:
Benzoic acid,3,4-bis(difluoromethoxy)-;3,4-Bis(difluoromethoxy)benzoic acid
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CAS No:
Characteristics
55.76000
2.35
1.473±0.06 g/cm3(Predicted)
293.3±35.0 °C(Predicted)
131.2±25.9 °C
1.458
3,4-Bis(difluoromethoxy)benzoic acid Use and Manufacturing
3,4-Bis(difluoromethoxy)benzoic Acid is an impurity of the antiasthmatic drug Roflumilast (R639700).
Computed Properties
Molecular Weight:254.13
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:254.02022132
Monoisotopic Mass:254.02022132
Topological Polar Surface Area:55.8
Heavy Atom Count:17
Complexity:261
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3,4-Bis(difluoromethoxy)benzoic acid
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