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Home Fluorides 328-74-5
328-74-5,MFCD00000394
Catalog No.:AA003IHO

328-74-5 | 3,5-Bis(trifluoromethyl)aniline

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$6.00   $4.00
- +
10g
98%
in stock  
$7.00   $5.00
- +
25g
98%
in stock  
$11.00   $8.00
- +
100g
98%
in stock  
$28.00   $20.00
- +
500g
98%
in stock  
$112.00   $78.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003IHO
Chemical Name:
3,5-Bis(trifluoromethyl)aniline
CAS Number:
328-74-5
Molecular Formula:
C8H5F6N
Molecular Weight:
229.1224
MDL Number:
MFCD00000394
SMILES:
Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F
NSC Number:
3411
Properties
Properties
 
BP:
175.5°C at 760 mmHg  
Form:
Liquid  
Refractive Index:
n20/D 1.434(lit.)  
Storage:
Light sensitive;Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
198  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
XLogP3:
3.6  

Upstream Synthesis Route

[1]OrganicLetters,2005,vol.7,#6,p.1169-1172

[2]OrganicLetters,2013,vol.15,#14,p.3734-3737

[1]JournaloftheAmericanChemicalSociety,2009,vol.131,#31,p.11049-11061

[1]Synthesis,2006,#19,p.3316-3340

[1]JournalofOrganicChemistryUSSR(EnglishTranslation),1980,vol.16,p.1031-1038

[2]ZhurnalOrganicheskoiKhimii,1980,vol.16,#6,p.1194-1202

[1]Tetrahedron,2010,vol.66,#38,p.7642-7650

[2]JournalofOrganicChemistry,2016,vol.81,#1,p.330-335

Downstream Synthesis Route

[1]JournaloftheAmericanChemicalSociety,1946,vol.68,p.1602,1603

[2]JournaloftheAmericanChemicalSociety,1951,vol.73,p.3579

[3]JournaloftheAmericanChemicalSociety,1953,vol.75,p.4967

[1]Patent:US2547679,1950,

[1]JustusLiebigsAnnalenderChemie,1970,vol.733,p.70-87

[1]JournalofOrganicChemistryUSSR(EnglishTranslation),1980,vol.16,p.1031-1038    ZhurnalOrganicheskoiKhimii,1980,vol.16,p.1194-1202

[1]JournalofOrganicChemistryUSSR(EnglishTranslation),1980,vol.16,p.1031-1038    ZhurnalOrganicheskoiKhimii,1980,vol.16,p.1194-1202

Literature

Title: Utilization of [11C]phosgene for radiosynthesis of N-(2-{3-[3,5-bis(trifluoromethyl)]phenyl[11C]ureido}ethyl)glycyrrhetinamide, an inhibitory agent for proteasome and kinase in tumors.

Journal: Bioorganic & medicinal chemistry letters 20120601

Title: Prediction of genotoxicity of chemical compounds by statistical learning methods.

Journal: Chemical research in toxicology 20050601

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SDS
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