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4-(trifluoroMethyl)-1h-indole-2-carboxylicacid

4-(trifluoroMethyl)-1h-indole-2-carboxylicacid structure

CAS No:
317-59-9
Formula:
C10H6F3NO2
Chemical Name:
4-(trifluoroMethyl)-1h-indole-2-carboxylicacid
Synonyms:
4-(trifluoroMethyl)-1h-indole-2-carboxylic acid;4-(Trifluoromethyl)-indole-2-carboxylic acid;1H-Indole-2-carboxylic acid, 4-(trifluoromethyl)-

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4-(trifluoroMethyl)-1h-indole-2-carboxylicacid Basic Attributes

Molecular Weight：

229.16

Exact Mass：

229.03506292

Characteristics

Density：

1.549±0.06 g/cm3

Melting Point：

219.4-220.4 °C

Boiling Point：

402.5±40.0 °C(Predicted)

PKA：

4.10±0.30

Computed Properties

Molecular Weight:229.15
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:229.03506292
Monoisotopic Mass:229.03506292
Topological Polar Surface Area:53.1
Heavy Atom Count:16
Complexity:292
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(trifluoroMethyl)-1h-indole-2-carboxylicacid

Basic Attributes
Characteristics
Computed Properties

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