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2-Allylthio-2-ethylbutyramide

2-Allylthio-2-ethylbutyramide structure

CAS No:
64037-65-6
Formula:
C9H17NOS
Chemical Name:
2-Allylthio-2-ethylbutyramide
Synonyms:
2-Allylthio-2-ethylbutyramide;2-Allylmercapto-2-ethylbutyramide;BUTYRAMIDE, 2-(ALLYLTHIO)-2-ETHYL-;BRN 1765155;Acetamide, 2-(allylthio)-2,2-diethyl-;MLS000738169;alpha-Allylmercapto-alpha,alpha-diethylacetamide;2-ethyl-2-allylmercapto-butyric acid amide;NSC37883;Butanamide, 2-ethyl-2-(2-propenylthio)-

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2-Allylthio-2-ethylbutyramide Basic Attributes

Molecular Weight：

187.301

Exact Mass：

187.103

NSC Number：

37883

DSSTox ID：

DTXSID90214053

Characteristics

PSA：

68.4

XLogP3：

2.1

Density：

1.0565 (rough estimate)

Toxicity：

Oral-mouse LD50: 891mg/kg; intraperitoneal-mouse LD50: 400 mg/kg

Flammability characteristics：

Flammable; burning produces toxic nitrogen oxides and sulfur oxide fumes

Safety Information

Storage features：

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

Toxicity

Toxicity class：

moderately toxic

Computed Properties

Molecular Weight:187.30
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:187.10308534
Monoisotopic Mass:187.10308534
Topological Polar Surface Area:68.4
Heavy Atom Count:12
Complexity:164
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Allylthio-2-ethylbutyramide

Basic Attributes
Characteristics
Safety Information
Toxicity
Computed Properties

2-Allylthio-2-ethylbutyramide

SDS

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