3-(Ethylthio)butanal
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3-(Ethylthio)butanal
structure -
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CAS No:
27205-24-9
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Formula:
C6H12OS
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Chemical Name:
3-(Ethylthio)butanal
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Synonyms:
Butanal,3-(ethylthio)-;Butyraldehyde,3-(ethylthio)-;3-(Ethylthio)butanal;β-(Ethylthio)butyraldehyde;3-(Ethylthio)butyraldehyde
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CAS No:
Characteristics
42.4
1.59
0.9±0.1 g/cm3
160-180 °C @ Press: 2 Torr
68.8±8.3 °C
1.458
0.557mmHg at 25°C
Computed Properties
Molecular Weight:132.23
XLogP3:1.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:132.06088618
Monoisotopic Mass:132.06088618
Topological Polar Surface Area:42.4
Heavy Atom Count:8
Complexity:63.5
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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