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Home > Encyclopedia > Bicyclo[2.2.2]octane-1-carboxylic acid, 4-[4-Methyl-5-[2-(trifluoroMethyl)phenyl]-4H-1,2,4-triazol-3-yl]-, Methyl ester

Bicyclo[2.2.2]octane-1-carboxylic acid, 4-[4-Methyl-5-[2-(trifluoroMethyl)phenyl]-4H-1,2,4-triazol-3-yl]-, Methyl ester

Bicyclo[2.2.2]octane-1-carboxylic acid, 4-[4-Methyl-5-[2-(trifluoroMethyl)phenyl]-4H-1,2,4-triazol-3-yl]-, Methyl ester structure

Bicyclo[2.2.2]octane-1-carboxylic acid, 4-[4-Methyl-5-[2-(trifluoroMethyl)phenyl]-4H-1,2,4-triazol-3-yl]-, Methyl ester 

structure
  • CAS No:

    719274-90-5

  • Formula:

    C20H22F3N3O2

  • Chemical Name:

    Bicyclo[2.2.2]octane-1-carboxylic acid, 4-[4-Methyl-5-[2-(trifluoroMethyl)phenyl]-4H-1,2,4-triazol-3-yl]-, Methyl ester

  • Synonyms:

    Methyl 4-(4-methyl-5-(2-(trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-yl)bicyclo[2.2.2]octane-1-carboxylate;methyl 4-{4-methyl-5-[2-(trifluoromethyl)phenyl]-4h-1,2,4-triazol-3-yl}bicyclo[2.2.2]octane-1-carboxylate;SCHEMBL1679814;DTXSID60609639;ZINC91302047;methyl 1-[4-methyl-5-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]bicyclo[2.2.2]octane-4-carboxylate

Bicyclo[2.2.2]octane-1-carboxylic acid, 4-[4-Methyl-5-[2-(trifluoroMethyl)phenyl]-4H-1,2,4-triazol-3-yl]-, Methyl ester Basic Attributes

393.4027896

393.16600

DTXSID60609639

2933990090

Characteristics

57.01000

4.26590

Computed Properties

Molecular Weight:393.4
XLogP3:3.4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:393.16641144
Monoisotopic Mass:393.16641144
Topological Polar Surface Area:57
Heavy Atom Count:28
Complexity:588
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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