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6-methyl-2-phenacylsulfanyl-1H-pyrimidin-4-one

6-methyl-2-phenacylsulfanyl-1H-pyrimidin-4-one structure

CAS No:
17649-31-9
Formula:
C13H12N2O2S
Chemical Name:
6-methyl-2-phenacylsulfanyl-1H-pyrimidin-4-one
Synonyms:
6-methyl-2-phenacylmercapto-3H-pyrimidin-4-one; 6-methyl-2-(2-oxo-2-phenyl-ethylsulfanyl)-3H-pyrimidin-4-one; 2-benzoylmethylthio-6-methylpyrimidin-4(1H)-one; 6-methyl-2-(2-oxo-2-phenylethylthio)pyrimidin-4(3H)-one; 6-Methyl-2-phenacylmercapto-3H-pyrimidin-4-on; 2-Phenacylmercapto-6-methyl-4-oxo-3.4-dihydro-pyrimidin; F0176-0059; 6-methyl-2-(2-oxo-2-phenylethylthio)-3-hydropyrimidin-4-one;Expand

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6-methyl-2-phenacylsulfanyl-1H-pyrimidin-4-one Basic Attributes

Molecular Weight：

260.31200

Exact Mass：

260.06194880

NSC Number：

338484

DSSTox ID：

DTXSID70319010

Characteristics

PSA：

88.12000

XLogP3：

2.05330

Density：

1.28g/cm3

Boiling Point：

426.8ºC at 760 mmHg

Flash Point：

211.9ºC

Refractive Index：

1.638

Vapor Pressure：

1.72E-07mmHg at 25°C

Computed Properties

Molecular Weight:260.31
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:260.06194880
Monoisotopic Mass:260.06194880
Topological Polar Surface Area:83.8
Heavy Atom Count:18
Complexity:409
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-methyl-2-phenacylsulfanyl-1H-pyrimidin-4-one

Basic Attributes
Characteristics
Computed Properties

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