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Home > Encyclopedia > [3-(1,3-benzothiazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 2-(4-bromophenoxy)acetate

[3-(1,3-benzothiazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 2-(4-bromophenoxy)acetate

[3-(1,3-benzothiazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 2-(4-bromophenoxy)acetate structure

[3-(1,3-benzothiazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 2-(4-bromophenoxy)acetate 

structure
  • CAS No:

    452931-59-8

  • Formula:

    C19H13BrN2O4S

  • Chemical Name:

    [3-(1,3-benzothiazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 2-(4-bromophenoxy)acetate

  • Synonyms:

    Z54178985;3-cyano-3-(2,3-dihydro-1,3-benzothiazol-2-ylidene)-2-oxopropyl 2-(4-bromophenoxy)acetate;452931-59-8

[3-(1,3-benzothiazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 2-(4-bromophenoxy)acetate Basic Attributes

445.3 g/mol

443.97794 g/mol

Characteristics

121 Ų

Computed Properties

Molecular Weight:445.3
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:443.97794
Monoisotopic Mass:443.97794
Topological Polar Surface Area:121
Heavy Atom Count:27
Complexity:612
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [3-(1,3-benzothiazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 2-(4-bromophenoxy)acetate

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