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Home > Encyclopedia > 2-(Methylthio)-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid

2-(Methylthio)-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid

2-(Methylthio)-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid structure

2-(Methylthio)-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid 

structure
  • CAS No:

    149771-17-5

  • Formula:

    C7H5F3N2O2S

  • Chemical Name:

    2-(Methylthio)-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid

  • Synonyms:

    5-Pyrimidinecarboxylic acid,2-(methylthio)-4-(trifluoromethyl)-;2-(Methylthio)-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid;2-(Methylsulfanyl)-4-(trifluoromethyl)pyrimidine-5-carboxylic acid

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

Description

White solid

2-(Methylthio)-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid Basic Attributes

238

238.19

DTXSID40425096

29335990

Characteristics

88.4

2.60

1.59

358.6±42.0 °C at 760 mmHg

170.7±27.9 °C

1.533

Safety Information

36/37/38

26-36

Computed Properties

Molecular Weight:238.19
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:2
Exact Mass:238.00238307
Monoisotopic Mass:238.00238307
Topological Polar Surface Area:88.4
Heavy Atom Count:15
Complexity:249
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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