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4-chloro-2-methylsulfanyl-6-phenylpyrimidine

4-chloro-2-methylsulfanyl-6-phenylpyrimidine structure

CAS No:
91063-60-4
Formula:
C11H9ClN2S
Chemical Name:
4-chloro-2-methylsulfanyl-6-phenylpyrimidine
Synonyms:
4-chloro-2-methylsulfanyl-6-phenylpyrimidine;Pyrimidine, 4-chloro-2-(methylthio)-6-phenyl-

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4-chloro-2-methylsulfanyl-6-phenylpyrimidine Basic Attributes

Molecular Weight：

236.72

Exact Mass：

236.0174972 g/mol

NSC Number：

49449

DSSTox ID：

DTXSID10287168

Characteristics

PSA：

51.1 Å²

Density：

1.33±0.1 g/cm3

Melting Point：

59.8 °C

Boiling Point：

381.9±22.0 °C(Predicted)

PKA：

-1.17±0.30

Computed Properties

Molecular Weight:236.72
XLogP3:3.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:236.0174972
Monoisotopic Mass:236.0174972
Topological Polar Surface Area:51.1
Heavy Atom Count:15
Complexity:197
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-chloro-2-methylsulfanyl-6-phenylpyrimidine

Basic Attributes
Characteristics
Computed Properties

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