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5-(ethylsulfanylmethyl)-5-(2-methylpropyl)-1,3-diazinane-2,4,6-trione

5-(ethylsulfanylmethyl)-5-(2-methylpropyl)-1,3-diazinane-2,4,6-trione structure

CAS No:
67051-07-4
Formula:
C11H18N2O3S
Chemical Name:
5-(ethylsulfanylmethyl)-5-(2-methylpropyl)-1,3-diazinane-2,4,6-trione
Synonyms:
DTXSID80873638;5-[(Ethylmercapto)methyl]-5-isobutylbarbituric acid;67051-07-4

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5-(ethylsulfanylmethyl)-5-(2-methylpropyl)-1,3-diazinane-2,4,6-trione Basic Attributes

Molecular Weight：

258.34 g/mol

Exact Mass：

258.10381361 g/mol

Characteristics

PSA：

101 Å²

XLogP3：

1.7956

Melting Point：

146.5 - 147 °C (ethanol)

Computed Properties

Molecular Weight:258.34
XLogP3:1.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:258.10381361
Monoisotopic Mass:258.10381361
Topological Polar Surface Area:101
Heavy Atom Count:17
Complexity:322
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(ethylsulfanylmethyl)-5-(2-methylpropyl)-1,3-diazinane-2,4,6-trione

Basic Attributes
Characteristics
Computed Properties

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