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4-[4-(4-Chlorophenyl)-3-methyl-1,3-butadien-1-yl]-2-(methylthio)pyrimidine

4-[4-(4-Chlorophenyl)-3-methyl-1,3-butadien-1-yl]-2-(methylthio)pyrimidine structure

CAS No:
7234-26-6
Formula:
C16H15ClN2S
Chemical Name:
4-[4-(4-Chlorophenyl)-3-methyl-1,3-butadien-1-yl]-2-(methylthio)pyrimidine
Synonyms:
Pyrimidine,4-[4-(4-chlorophenyl)-3-methyl-1,3-butadien-1-yl]-2-(methylthio)-;Pyrimidine,4-[4-(p-chlorophenyl)-3-methyl-1,3-butadienyl]-2-(methylthio)-;Pyrimidine,4-[4-(4-chlorophenyl)-3-methyl-1,3-butadienyl]-2-(methylthio)-;4-[4-(4-Chlorophenyl)-3-methyl-1,3-butadien-1-yl]-2-(methylthio)pyrimidine

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4-[4-(4-Chlorophenyl)-3-methyl-1,3-butadien-1-yl]-2-(methylthio)pyrimidine Basic Attributes

Molecular Weight：

500.64700

Exact Mass：

302.82

DSSTox ID：

DTXSID00413237

Characteristics

PSA：

106.12000

XLogP3：

5.20160

Density：

1.29g/cm3

Boiling Point：

676.7ºC

Flash Point：

363.1ºC

Refractive Index：

1.599

Computed Properties

Molecular Weight:500.6
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:500.22326004
Monoisotopic Mass:500.22326004
Topological Polar Surface Area:106
Heavy Atom Count:35
Complexity:1010
Undefined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[4-(4-Chlorophenyl)-3-methyl-1,3-butadien-1-yl]-2-(methylthio)pyrimidine

Basic Attributes
Characteristics
Computed Properties

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