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Home > Encyclopedia > 4-CHLORO-3-[[[[(2-CHLOROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID

4-CHLORO-3-[[[[(2-CHLOROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID

4-CHLORO-3-[[[[(2-CHLOROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID structure

4-CHLORO-3-[[[[(2-CHLOROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID 

structure
  • CAS No:

    531543-15-4

  • Formula:

    C16H12Cl2N2O4S

  • Chemical Name:

    4-CHLORO-3-[[[[(2-CHLOROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID

  • Synonyms:

    STK072057;4-chloro-3-({[(2-chlorophenoxy)acetyl]carbamothioyl}amino)benzoic acid;DTXSID50404059;ZINC4599738;AKOS000294247;MCULE-5790211636

4-CHLORO-3-[[[[(2-CHLOROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID Basic Attributes

399.242

397.989

DTXSID50404059

Characteristics

120

4.3

1.549±0.06 g/cm3(Predicted)

Computed Properties

Molecular Weight:399.2
XLogP3:4.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:397.9894834
Monoisotopic Mass:397.9894834
Topological Polar Surface Area:120
Heavy Atom Count:25
Complexity:509
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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