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5-Allyl-5-(1-methylallyl)-2-sodiothio-4,6(1H,5H)-pyrimidinedione

5-Allyl-5-(1-methylallyl)-2-sodiothio-4,6(1H,5H)-pyrimidinedione structure

CAS No:
66941-77-3
Formula:
C11H13N2NaO2S
Chemical Name:
5-Allyl-5-(1-methylallyl)-2-sodiothio-4,6(1H,5H)-pyrimidinedione
Synonyms:
DTXSID50985676;5-Allyl-5-(1-methylallyl)-2-sodiothio-4,6(1H,5H)-pyrimidinedione;Sodium 5-(but-3-en-2-yl)-6-hydroxy-5-(prop-2-en-1-yl)-2-sulfanylidene-2,5-dihydropyrimidin-4-olate

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5-Allyl-5-(1-methylallyl)-2-sodiothio-4,6(1H,5H)-pyrimidinedione Basic Attributes

Molecular Weight：

260.29

Exact Mass：

260.059543

Characteristics

PSA：

96.6

Toxicity：

Abdominal-rat LD50: 126 mg/kg; intravenous-rabbit LD50: 58 mg/kg

Flammability characteristics：

Flammable; burning produces toxic sulfur oxides, nitrogen oxides and sodium oxide fumes

Safety Information

Storage features：

Treasury is ventilated, low temperature and dry; stored separately from food materials

Toxicity

Toxicity class：

highly toxic

Computed Properties

Molecular Weight:260.29
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:260.05954312
Monoisotopic Mass:260.05954312
Topological Polar Surface Area:96.6
Heavy Atom Count:17
Complexity:395
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 5-Allyl-5-(1-methylallyl)-2-sodiothio-4,6(1H,5H)-pyrimidinedione

Basic Attributes
Characteristics
Safety Information
Toxicity
Computed Properties

5-Allyl-5-(1-methylallyl)-2-sodiothio-4,6(1H,5H)-pyrimidinedione

SDS

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