Cas no 1314985-42-6 (N-(tert-Butyl)-2,3-difluoro-6-nitroaniline)

N-(tert-Butyl)-2,3-difluoro-6-nitroaniline is a fluorinated nitroaniline derivative characterized by its tert-butylamino substituent and strategically positioned fluorine atoms. This compound is primarily utilized as an intermediate in organic synthesis, particularly in the development of agrochemicals and pharmaceuticals, where its electron-withdrawing nitro and fluorine groups enhance reactivity and selectivity. The tert-butyl moiety contributes to steric hindrance, improving stability and influencing regioselectivity in subsequent reactions. Its well-defined molecular structure makes it valuable for constructing complex heterocycles or functionalized aromatic systems. The compound's purity and consistent performance under controlled conditions ensure reliable results in research and industrial applications. Proper handling is advised due to potential sensitivity to light and heat.
N-(tert-Butyl)-2,3-difluoro-6-nitroaniline structure
1314985-42-6 structure
Product Name:N-(tert-Butyl)-2,3-difluoro-6-nitroaniline
CAS No:1314985-42-6
MF:C10H12F2N2O2
MW:230.211289405823
MDL:MFCD19684089
CID:1024859
PubChem ID:54759078
Update Time:2025-06-07

N-(tert-Butyl)-2,3-difluoro-6-nitroaniline Chemical and Physical Properties

Names and Identifiers

    • N-(tert-Butyl)-2,3-difluoro-6-nitroaniline
    • AKOS015908069
    • MFCD19684089
    • BS-20528
    • DTXSID10716680
    • A888444
    • Benzenamine, N-(1,1-dimethylethyl)-2,3-difluoro-6-nitro-
    • CS-0208672
    • SB77109
    • 1314985-42-6
    • N-tert-Butyl-2,3-difluoro-6-nitroaniline
    • MDL： MFCD19684089
    • Inchi： 1S/C10H12F2N2O2/c1-10(2,3)13-9-7(14(15)16)5-4-6(11)8(9)12/h4-5,13H,1-3H3
    • InChI Key： QWJMAEKNTLZLCT-UHFFFAOYSA-N
    • SMILES： FC1=C(C=CC(=C1NC(C)(C)C)[N+](=O)[O-])F

Computed Properties

  • Exact Mass: 230.08668395g/mol
  • Monoisotopic Mass: 230.08668395g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 263
  • 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: 3.5
  • Topological Polar Surface Area: 57.8?2

N-(tert-Butyl)-2,3-difluoro-6-nitroaniline Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd.
N181124-100g
N-(tert-Butyl)-2,3-difluoro-6-nitroaniline
 1314985-42-6 98%
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 $ 65.00 2022-06-03
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1PlusChem
1P000WSV-1g
Benzenamine, N-(1,1-dimethylethyl)-2,3-difluoro-6-nitro-
 1314985-42-6 98%
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1PlusChem
1P000WSV-5g
Benzenamine, N-(1,1-dimethylethyl)-2,3-difluoro-6-nitro-
 1314985-42-6 98%
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1PlusChem
1P000WSV-25g
Benzenamine, N-(1,1-dimethylethyl)-2,3-difluoro-6-nitro-
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1PlusChem
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