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Home > Encyclopedia > 2-CHLORO-4-CYANOBENZOIC ACID

2-CHLORO-4-CYANOBENZOIC ACID

2-CHLORO-4-CYANOBENZOIC ACID structure

2-CHLORO-4-CYANOBENZOIC ACID 

structure
  • CAS No:

    117738-77-9

  • Formula:

    C8H4ClNO2

  • Chemical Name:

    2-CHLORO-4-CYANOBENZOIC ACID

  • Synonyms:

    2-chloro-4-cyanobenzoic acid;Benzoic acid, 2-chloro-4-cyano-;MFCD11036377;NSC28694;SCHEMBL508503;Benzoicacid,2-chloro-4-cyano-;CTK7C7505;KS-000004TT;ZINC1646628;5509AJ

2-CHLORO-4-CYANOBENZOIC ACID Basic Attributes

181.57

180.9930561

28694

2926909090

Computed Properties

Molecular Weight:181.57
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:180.9930561
Monoisotopic Mass:180.9930561
Topological Polar Surface Area:61.1
Heavy Atom Count:12
Complexity:233
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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