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2-Bromo-4-cyano-6-iodophenyl octanoate

2-Bromo-4-cyano-6-iodophenyl octanoate structure

2-Bromo-4-cyano-6-iodophenyl octanoate 

structure
  • CAS No:

    93777-16-3

  • Formula:

    C15H17BrINO2

  • Chemical Name:

    2-Bromo-4-cyano-6-iodophenyl octanoate

  • Synonyms:

    Octanoic acid,2-bromo-4-cyano-6-iodophenyl ester;2-Bromo-4-cyano-6-iodophenyl octanoate

2-Bromo-4-cyano-6-iodophenyl octanoate Basic Attributes

450.10945

450.11

298-045-6

DTXSID70239608

Characteristics

50.1

5.7

Computed Properties

Molecular Weight:450.11
XLogP3:5.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:8
Exact Mass:448.94874
Monoisotopic Mass:448.94874
Topological Polar Surface Area:50.1
Heavy Atom Count:20
Complexity:355
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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