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3-[3-Methoxy-5-(trifluoromethyl)phenyl]propionicacid

3-[3-Methoxy-5-(trifluoromethyl)phenyl]propionicacid structure

CAS No:
881190-34-7
Formula:
C11H11F3O3
Chemical Name:
3-[3-Methoxy-5-(trifluoromethyl)phenyl]propionicacid
Synonyms:
3-[3-Methoxy-5-(trifluoromethyl)phenyl]propionicacid;Benzenepropanoic acid, 3-methoxy-5-(trifluoromethyl)-

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3-[3-Methoxy-5-(trifluoromethyl)phenyl]propionicacid Basic Attributes

Molecular Weight：

248.2

Exact Mass：

248.06602869

Characteristics

Density：

1.300±0.06 g/cm3

Melting Point：

71-73℃

Boiling Point：

312.0±42.0 °C(Predicted)

PKA：

4.55±0.10

Computed Properties

Molecular Weight:248.20
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:248.06602869
Monoisotopic Mass:248.06602869
Topological Polar Surface Area:46.5
Heavy Atom Count:17
Complexity:265
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[3-Methoxy-5-(trifluoromethyl)phenyl]propionicacid

Basic Attributes
Characteristics
Computed Properties

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