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

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

CAS No:
64058-13-5
Formula:
C14H13N2NaO2S
Chemical Name:
5-Allyl-5-benzyl-2-sodiothio-4,6(1H,5H)-pyrimidinedione
Synonyms:
Sodium allylbenzyl thiobarbiturate;BARBITURIC ACID, 5-ALLYL-5-BENZYL-2-THIO-, SODIUM SALT;5-Allyl-5-benzyl-2-thiobarbituric acid sodium salt;CTK8J8088;DTXSID70214218;LS-23670

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

Molecular Weight：

296.32

Exact Mass：

296.059543

DSSTox ID：

DTXSID70214218

Characteristics

PSA：

59.5

Toxicity：

Oral-rat LDL0: 40 mg/kg; Celiac-ratLDL0: 20 mg/kg

Flammability characteristics：

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

Safety Information

RTECS Number：

CP8120000

Storage features：

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

Toxicity

Toxicity class：

most toxic

Computed Properties

Molecular Weight:296.32
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:296.05954312
Monoisotopic Mass:296.05954312
Topological Polar Surface Area:59.5
Heavy Atom Count:20
Complexity:433
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Safety Information
Toxicity
Computed Properties

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

SDS

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