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3-Oxo-5-phenyl-4-pentenoicacidmethylester

3-Oxo-5-phenyl-4-pentenoicacidmethylester structure

CAS No:
51081-29-9
Formula:
C12H12O3
Chemical Name:
3-Oxo-5-phenyl-4-pentenoicacidmethylester
Synonyms:
3-Oxo-5-phenyl-4-pentenoic acid methyl ester;4-Pentenoic acid, 3-oxo-5-phenyl-, methyl ester

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3-Oxo-5-phenyl-4-pentenoicacidmethylester Basic Attributes

Molecular Weight：

204.22

Exact Mass：

204.078644241

Characteristics

Density：

1.131±0.06 g/cm3

Melting Point：

73-74 °C

Boiling Point：

330.6±25.0 °C(Predicted)

PKA：

10.31±0.46

Computed Properties

Molecular Weight:204.22
XLogP3:2.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:204.078644241
Monoisotopic Mass:204.078644241
Topological Polar Surface Area:43.4
Heavy Atom Count:15
Complexity:250
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-Oxo-5-phenyl-4-pentenoicacidmethylester

Basic Attributes
Characteristics
Computed Properties

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