Cas no 112055-38-6 (1H-Pyrazole-4-carboxylicacid, 1-(4-methoxyphenyl)-5-(trifluoromethyl)-, ethyl ester)

1H-Pyrazole-4-carboxylicacid, 1-(4-methoxyphenyl)-5-(trifluoromethyl)-, ethyl ester structure
112055-38-6 structure
Product Name:1H-Pyrazole-4-carboxylicacid, 1-(4-methoxyphenyl)-5-(trifluoromethyl)-, ethyl ester
CAS No:112055-38-6
MF:C14H13F3N2O3
MW:314.259834051132
MDL:MFCD04972911
CID:129512
PubChem ID:13812946
Update Time:2025-04-19

1H-Pyrazole-4-carboxylicacid, 1-(4-methoxyphenyl)-5-(trifluoromethyl)-, ethyl ester Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrazole-4-carboxylicacid, 1-(4-methoxyphenyl)-5-(trifluoromethyl)-, ethyl ester
    • ethyl 1-(4-methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylate
    • ETHYL 1-(4-METHOXYPHENYL)-5-(TRIFLUOROMETHYL)PYRAZOLE-4-CARBOXYLATE
    • ETHYL 1-(4-METHOXY-PHENYL)-5-TRIFLUOROMETHYL-1H-PYRAZOLE-4-CARBOXYLATE
    • ACMC-20mfel
    • AG-D-30895
    • AGN-PC-00O3CQ
    • CTK4A7622
    • KB-251864
    • SureCN2722465
    • Ethyl 5-(trifluoromethyl)-1-(4-methoxyphenyl)-1H-pyrazole-4-carboxylate
    • 112055-38-6
    • DTXSID50550282
    • MFCD04972911
    • FT-0704388
    • SCHEMBL2722465
    • ethyl 1-(4-methoxyphenyl)-5-trifluoromethyl-1h-pyrazole-4-carboxylate
    • MDL: MFCD04972911
    • Inchi: 1S/C14H13F3N2O3/c1-3-22-13(20)11-8-18-19(12(11)14(15,16)17)9-4-6-10(21-2)7-5-9/h4-8H,3H2,1-2H3
    • InChI Key: AKJLMZLGGRBYEM-UHFFFAOYSA-N
    • SMILES: FC(C1=C(C(=O)OCC)C=NN1C1C=CC(=CC=1)OC)(F)F

Computed Properties

  • Exact Mass: 314.08789
  • Monoisotopic Mass: 314.08782677g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 5
  • Complexity: 384
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3
  • Topological Polar Surface Area: 53.4?2

Experimental Properties

  • PSA: 53.35
  • LogP: 3.07640

1H-Pyrazole-4-carboxylicacid, 1-(4-methoxyphenyl)-5-(trifluoromethyl)-, ethyl ester Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB148494-1 g
Ethyl 1-(4-methoxyphenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate; 98%
112055-38-6
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€350.00 2022-03-05
abcr
AB148494-5 g
Ethyl 1-(4-methoxyphenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate; 98%
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abcr
AB148494-1g
Ethyl 1-(4-methoxyphenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate, 98%; .
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abcr
AB148494-5g
Ethyl 1-(4-methoxyphenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate, 98%; .
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