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Home > Encyclopedia > 5-(CARBOXYMETHYL)-1-[4-(TRIFLUOROMETHOXY)PHENYL]-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID

5-(CARBOXYMETHYL)-1-[4-(TRIFLUOROMETHOXY)PHENYL]-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID

5-(CARBOXYMETHYL)-1-[4-(TRIFLUOROMETHOXY)PHENYL]-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID structure

5-(CARBOXYMETHYL)-1-[4-(TRIFLUOROMETHOXY)PHENYL]-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID 

structure
  • CAS No:

    439095-12-2

  • Formula:

    C12H8F3N3O5

  • Chemical Name:

    5-(CARBOXYMETHYL)-1-[4-(TRIFLUOROMETHOXY)PHENYL]-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID

  • Synonyms:

    5-(Carboxymethyl)-1-[4-(trifluoromethoxy)phenyl]-1H-1,2,3-triazole-4-carboxylic acid;5-(Carboxymethyl)-1-(4-(trifluoromethoxy)phenyl)-1H-1,2,3-triazole-4-carboxylic acid;CTK7J2188;ZINC168521;KS-00001V9I;AKOS005069932;3E-034

  • Categories:

    Organic Chemistry  >  Ethers and Derivatives

5-(CARBOXYMETHYL)-1-[4-(TRIFLUOROMETHOXY)PHENYL]-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID Basic Attributes

331.2

331.042

Characteristics

115

1.9

1.66±0.1 g/cm3(Predicted)

189-190°C

Safety Information

IRRITANT

Xi

Irritant

Computed Properties

Molecular Weight:331.20
XLogP3:1.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:5
Exact Mass:331.04160485
Monoisotopic Mass:331.04160485
Topological Polar Surface Area:115
Heavy Atom Count:23
Complexity:454
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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