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5-Pyrimidinol,2-(butylthio)-

5-Pyrimidinol,2-(butylthio)- structure

CAS No:
49547-40-2
Formula:
C8H12N2OS
Chemical Name:
5-Pyrimidinol,2-(butylthio)-
Synonyms:
5-Pyrimidinol, 2-(butylthio)-;2-(Butylsulfanyl)pyrimidin-5-ol

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5-Pyrimidinol,2-(butylthio)- Basic Attributes

Molecular Weight：

184.26

Exact Mass：

184.067

Characteristics

PSA：

71.31

XLogP3：

2.0744

Density：

1.20±0.1 g/cm3

Melting Point：

114 °C

Boiling Point：

328.2±15.0 °C(Predicted)

PKA：

6.47±0.36

Computed Properties

Molecular Weight:184.26
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:184.06703418
Monoisotopic Mass:184.06703418
Topological Polar Surface Area:71.3
Heavy Atom Count:12
Complexity:116
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Pyrimidinol,2-(butylthio)-

Basic Attributes
Characteristics
Computed Properties

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