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Home > Encyclopedia > 3-[(4,6-Dimethyl-2-pyrimidinyl)thio]propanoic acid

3-[(4,6-Dimethyl-2-pyrimidinyl)thio]propanoic acid

3-[(4,6-Dimethyl-2-pyrimidinyl)thio]propanoic acid structure

3-[(4,6-Dimethyl-2-pyrimidinyl)thio]propanoic acid 

structure
  • CAS No:

    247225-29-2

  • Formula:

    C9H12N2O2S

  • Chemical Name:

    3-[(4,6-Dimethyl-2-pyrimidinyl)thio]propanoic acid

  • Synonyms:

    Propanoic acid,3-[(4,6-dimethyl-2-pyrimidinyl)thio]-;3-[(4,6-Dimethyl-2-pyrimidinyl)thio]propanoic acid;2-(2-Carboxyethyl)thio-4,6-dimethylpyrimidine;3-[(4,6-Dimethylpyrimidin-2-yl)sulfanyl]propanoic acid

Description

Off-white solid

3-[(4,6-Dimethyl-2-pyrimidinyl)thio]propanoic acid Basic Attributes

212.27

212.27

DTXSID00350173

2933599090

Characteristics

88.4

1.66020

1.27±0.1 g/cm3(Predicted)

Safety Information

IRRITANT

36-34

26-45-36/37/39

Xi

Computed Properties

Molecular Weight:212.27
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:212.06194880
Monoisotopic Mass:212.06194880
Topological Polar Surface Area:88.4
Heavy Atom Count:14
Complexity:191
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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