Cas no 1006333-68-1 (methyl 3-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoate)

methyl 3-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoate structure
1006333-68-1 structure
Product Name:methyl 3-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoate
CAS No:1006333-68-1
MF:C8H9F3N2O2
MW:222.164472341537
MDL:MFCD08559101
CID:3056951
PubChem ID:19576906
Update Time:2025-04-21

methyl 3-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoate Chemical and Physical Properties

Names and Identifiers

    • Methyl 3-(3-(trifluoromethyl)-1H-pyrazol-1-yl)propanoate
    • methyl 3-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoate
    • STK351642
    • 1006333-68-1
    • CS-0302096
    • EN300-231289
    • AKOS003673561
    • methyl 3-[3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoate
    • methyl 3-[3-(trifluoromethyl)pyrazolyl]propanoate
    • methyl 3-[3-(trifluoromethyl)pyrazol-1-yl]propanoate
    • MDL： MFCD08559101
    • Inchi： 1S/C8H9F3N2O2/c1-15-7(14)3-5-13-4-2-6(12-13)8(9,10)11/h2,4H,3,5H2,1H3
    • InChI Key： AEDCITPJORNFRN-UHFFFAOYSA-N
    • SMILES： FC(C1C=CN(CCC(=O)OC)N=1)(F)F

Computed Properties

  • Exact Mass: 222.06161202Da
  • Monoisotopic Mass: 222.06161202Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 5
  • Complexity: 232
  • 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: 0.9
  • Topological Polar Surface Area: 44.1?2

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Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
eNovation Chemicals LLC
Y1289236-5g
methyl 3-[3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoate
 1006333-68-1 97%
5g
 $1200 2023-09-03
Enamine
EN300-231289-0.05g
methyl 3-[3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoate
 1006333-68-1 95%
0.05g
 $88.0 2024-06-20
Enamine
EN300-231289-0.1g
methyl 3-[3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoate
 1006333-68-1 95%
0.1g
 $132.0 2024-06-20
Enamine
EN300-231289-0.25g
methyl 3-[3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoate
 1006333-68-1 95%
0.25g
 $188.0 2024-06-20
Enamine
EN300-231289-0.5g
methyl 3-[3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoate
 1006333-68-1 95%
0.5g
 $353.0 2024-06-20
Enamine
EN300-231289-1.0g
methyl 3-[3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoate
 1006333-68-1 95%
1.0g
 $470.0 2024-06-20
Enamine
EN300-231289-2.5g
methyl 3-[3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoate
 1006333-68-1 95%
2.5g
 $923.0 2024-06-20
Enamine
EN300-231289-5.0g
methyl 3-[3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoate
 1006333-68-1 95%
5.0g
 $1364.0 2024-06-20
Enamine
EN300-231289-10.0g
methyl 3-[3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoate
 1006333-68-1 95%
10.0g
 $2024.0 2024-06-20
Enamine
EN300-231289-1g
methyl 3-[3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoate
 1006333-68-1
1g
 $470.0 2023-09-15

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