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Home > Encyclopedia > 1-(4-Cyano-benzyl)-azetidine-3-carboxylic acid 4-cyano-benzyl ester

1-(4-Cyano-benzyl)-azetidine-3-carboxylic acid 4-cyano-benzyl ester

1-(4-Cyano-benzyl)-azetidine-3-carboxylic acid 4-cyano-benzyl ester structure

1-(4-Cyano-benzyl)-azetidine-3-carboxylic acid 4-cyano-benzyl ester 

structure
  • CAS No:

    1353985-29-1

  • Formula:

    C20H17N3O2

  • Chemical Name:

    1-(4-Cyano-benzyl)-azetidine-3-carboxylic acid 4-cyano-benzyl ester

  • Synonyms:

    1-(4-Cyano-benzyl)-azetidine-3-carboxylic acid 4-cyano-benzyl ester;4-Cyanobenzyl 1-(4-cyanobenzyl)azetidine-3-carboxylate

1-(4-Cyano-benzyl)-azetidine-3-carboxylic acid 4-cyano-benzyl ester Basic Attributes

331.36788

331.132

Characteristics

77.1

2.3

1.28±0.1 g/cm3(Predicted)

512.9±50.0 °C(Predicted)

Computed Properties

Molecular Weight:331.4
XLogP3:2.3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:331.132076794
Monoisotopic Mass:331.132076794
Topological Polar Surface Area:77.1
Heavy Atom Count:25
Complexity:550
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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