CHEMBRDG-BB 4012563
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CHEMBRDG-BB 4012563
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CAS No:
16810-19-8
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Formula:
C11H10OS
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Chemical Name:
CHEMBRDG-BB 4012563
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Synonyms:
CHEMBRDG-BB 4012563;1-(2-METHYL-1-BENZOTHIEN-3-YL)ETHANONE;1-(2-methyl-1-benzothien-3-yl)ethanone(SALTDATA: FREE);acetaldehyde compound with benzo[b]thiophene (1:1)
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CAS No:
Characteristics
45.3
3
1.182±0.06 g/cm3(Predicted)
69-70 °C
184-188 °C(Press: 23 Torr)
147ºC
1.631
0.000337mmHg at 25°C
Computed Properties
Molecular Weight:190.26
XLogP3:3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:190.04523611
Monoisotopic Mass:190.04523611
Topological Polar Surface Area:45.3
Heavy Atom Count:13
Complexity:214
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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