[3-(1,3-benzothiazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 2-(4-bromophenoxy)acetate
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[3-(1,3-benzothiazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 2-(4-bromophenoxy)acetate
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CAS No:
452931-59-8
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Formula:
C19H13BrN2O4S
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Chemical Name:
[3-(1,3-benzothiazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 2-(4-bromophenoxy)acetate
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Synonyms:
Z54178985;3-cyano-3-(2,3-dihydro-1,3-benzothiazol-2-ylidene)-2-oxopropyl 2-(4-bromophenoxy)acetate;452931-59-8
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CAS No:
[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
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
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