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2-[(4-chlorobenzyl)sulfanyl]-6-methyl-4(3H)-pyrimidinone

2-[(4-chlorobenzyl)sulfanyl]-6-methyl-4(3H)-pyrimidinone structure

CAS No:
159333-55-8
Formula:
C12H11ClN2OS
Chemical Name:
2-[(4-chlorobenzyl)sulfanyl]-6-methyl-4(3H)-pyrimidinone
Synonyms:
2-[(4-chlorobenzyl)sulfanyl]-6-methyl-4(3H)-pyrimidinone

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2-[(4-chlorobenzyl)sulfanyl]-6-methyl-4(3H)-pyrimidinone Basic Attributes

Molecular Weight：

266.74654

Exact Mass：

266.028

Characteristics

PSA：

66.8

XLogP3：

2.7

Density：

1.34±0.1 g/cm3(Predicted)

Boiling Point：

402.8±47.0 °C(Predicted)

Water Solubility：

13.2 [ug/mL]

Computed Properties

Molecular Weight:266.75
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:266.0280618
Monoisotopic Mass:266.0280618
Topological Polar Surface Area:66.8
Heavy Atom Count:17
Complexity:360
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(4-chlorobenzyl)sulfanyl]-6-methyl-4(3H)-pyrimidinone

Basic Attributes
Characteristics
Computed Properties

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