Cas no 887351-41-9 (N-Cyclopropyl-2-nitro-4-trifluoromethylaniline)

N-Cyclopropyl-2-nitro-4-trifluoromethylaniline is a specialized aromatic amine derivative featuring a cyclopropyl substituent, a nitro group, and a trifluoromethyl group on the benzene ring. This compound is of interest in synthetic organic chemistry due to its unique structural motifs, which are valuable intermediates in the development of agrochemicals and pharmaceuticals. The presence of the electron-withdrawing nitro and trifluoromethyl groups enhances its reactivity in electrophilic substitution and nucleophilic aromatic substitution reactions. The cyclopropyl moiety may contribute to steric and electronic effects, influencing selectivity in synthetic pathways. Its well-defined structure makes it suitable for applications requiring precise functionalization or as a building block for more complex molecules.
N-Cyclopropyl-2-nitro-4-trifluoromethylaniline structure
887351-41-9 structure
Product Name:N-Cyclopropyl-2-nitro-4-trifluoromethylaniline
CAS No:887351-41-9
MF:C10H9F3N2O2
MW:246.185872793198
MDL:MFCD06149926
CID:712978
PubChem ID:17381695
Update Time:2025-10-16

N-Cyclopropyl-2-nitro-4-trifluoromethylaniline Chemical and Physical Properties

Names and Identifiers

    • N-Cyclopropyl-2-nitro-4-(trifluoromethyl)aniline
    • Benzenamine,N-cyclopropyl-2-nitro-4-(trifluoromethyl)-
    • N-Cyclopropyl-2-nitro-4-trifluoromethylaniline
    • A861521
    • MFCD06149926
    • DTXSID90589556
    • CS-0458545
    • LS-07607
    • 887351-41-9
    • SB77282
    • AKOS003348669
    • cyclopropyl[2-nitro-4-(trifluoromethyl)phenyl]amine
    • ALBB-023875
    • MDL: MFCD06149926
    • Inchi: 1S/C10H9F3N2O2/c11-10(12,13)6-1-4-8(14-7-2-3-7)9(5-6)15(16)17/h1,4-5,7,14H,2-3H2
    • InChI Key: TVYYMXQIRKBFDY-UHFFFAOYSA-N
    • SMILES: FC(C1C=CC(=C(C=1)[N+](=O)[O-])NC1CC1)(F)F

Computed Properties

  • Exact Mass: 246.06200
  • Monoisotopic Mass: 246.06161202g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 299
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 57.8?2

Experimental Properties

  • PSA: 57.85000
  • LogP: 3.78410

N-Cyclopropyl-2-nitro-4-trifluoromethylaniline Customs Data

  • HS CODE:2921420090
  • Customs Data:

    China Customs Code:

    2921420090

    Overview:

    2921420090 Other aniline derivatives and their salts. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    HS:2921420090 aniline derivatives and their salts VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

N-Cyclopropyl-2-nitro-4-trifluoromethylaniline Pricemore >>

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