3-OXO-2-(2-PHENYLHYDRAZONO)-3-(2-THIENYL)PROPANAL
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3-OXO-2-(2-PHENYLHYDRAZONO)-3-(2-THIENYL)PROPANAL
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CAS No:
337512-14-8
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Formula:
C13H10N2O2S
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Chemical Name:
3-OXO-2-(2-PHENYLHYDRAZONO)-3-(2-THIENYL)PROPANAL
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Synonyms:
3-OXO-2-(2-PHENYLHYDRAZONO)-3-(2-THIENYL)PROPANAL;(2E)-3-oxo-2-(2-phenylhydrazin-1-ylidene)-3-(thiophen-2-yl)propanal;2-Thiophenepropanal, β-oxo-α-(2-phenylhydrazinylidene)-, (αE)-
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CAS No:
Characteristics
86.77
2.6708
1.26±0.1 g/cm3
113-114 °C(Solv: ethanol (64-17-5))
418.2±37.0 °C(Predicted)
6.46±0.10
Computed Properties
Molecular Weight:258.30
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:258.04629874
Monoisotopic Mass:258.04629874
Topological Polar Surface Area:90.3
Heavy Atom Count:18
Complexity:349
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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