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Home > Encyclopedia > 1-(Phenylmethyl) 2-(3-thienyl)propanedioate

1-(Phenylmethyl) 2-(3-thienyl)propanedioate

1-(Phenylmethyl) 2-(3-thienyl)propanedioate structure

1-(Phenylmethyl) 2-(3-thienyl)propanedioate 

structure
  • CAS No:

    21080-93-3

  • Formula:

    C14H12O4S

  • Chemical Name:

    1-(Phenylmethyl) 2-(3-thienyl)propanedioate

  • Synonyms:

    Propanedioic acid,2-(3-thienyl)-,1-(phenylmethyl) ester;3-Thiophenemalonic acid,monobenzyl ester;Propanedioic acid,3-thienyl-,mono(phenylmethyl) ester;1-(Phenylmethyl) 2-(3-thienyl)propanedioate;3-Thienylmalonic acid monobenzyl ester

1-(Phenylmethyl) 2-(3-thienyl)propanedioate Basic Attributes

276.30768

276.31

244-199-4

Characteristics

91.8

2.7

Computed Properties

Molecular Weight:276.31
XLogP3:2.9
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:276.04563003
Monoisotopic Mass:276.04563003
Topological Polar Surface Area:80.8
Heavy Atom Count:19
Complexity:313
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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