4-(2-Thienyl)-3-buten-2-one
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4-(2-Thienyl)-3-buten-2-one
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CAS No:
874-83-9
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Formula:
C8H8OS
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Chemical Name:
4-(2-Thienyl)-3-buten-2-one
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Synonyms:
3-Buten-2-one,4-(2-thienyl)-;4-(2-Thienyl)-3-buten-2-one;2-Thienylidenacetone;2-(3-Oxo-1-butenyl)thiophene;2-Thenylideneacetone;929900-27-6
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CAS No:
Characteristics
45.31000
2.35030
Clear yellow liquid after melting
1.151 g/mL at 25 °C(lit.)
34-35 °C
112-114 °C @ Press: 3 Torr
230 °F
1.6285-1.6315
Computed Properties
Molecular Weight:152.22
XLogP3:1.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:152.02958605
Monoisotopic Mass:152.02958605
Topological Polar Surface Area:45.3
Heavy Atom Count:10
Complexity:151
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
