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Home > Encyclopedia > cyanomethyl 4-oxochromene-2-carboxylate

cyanomethyl 4-oxochromene-2-carboxylate

cyanomethyl 4-oxochromene-2-carboxylate structure

cyanomethyl 4-oxochromene-2-carboxylate 

structure
  • CAS No:

    80253-65-2

  • Formula:

    C12H7NO4

  • Chemical Name:

    cyanomethyl 4-oxochromene-2-carboxylate

  • Synonyms:

    80253-65-2;4H-1-Benzopyran-2-carboxylic acid, 4-oxo-, cyanomethyl ester;HMS1757O12;ZINC3320648;AKOS033624903;MCULE-5228418046;cyanomethyl 4-oxo-4H-chromene-2-carboxylate;Z18483217

cyanomethyl 4-oxochromene-2-carboxylate Basic Attributes

229.19 g/mol

229.03750770 g/mol

Characteristics

76.4 Ų

1.47338

112 °C (diethyl ether)

Computed Properties

Molecular Weight:229.19
XLogP3:1.7
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:229.03750770
Monoisotopic Mass:229.03750770
Topological Polar Surface Area:76.4
Heavy Atom Count:17
Complexity:418
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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