2,2,3,3,4,4,4-Heptafluorobutylamine

Base Information

• Chemical Name: 2,2,3,3,4,4,4-Heptafluorobutylamine
• CAS No.: 374-99-2
• Molecular Formula: C4H4F7N
• Molecular Weight: 199.071
• Hs Code.: 29211990
• European Community (EC) Number: 206-780-0
• DSSTox Substance ID: DTXSID10190840
• Nikkaji Number: J42.745D
• Wikidata: Q81985532
• Mol file: 374-99-2.mol

Synonyms:2,2,3,3,4,4,4-Heptafluorobutylamine;374-99-2;1H,1H-Heptafluorobutylamine;2,2,3,3,4,4,4-heptafluorobutan-1-amine;C4H4F7N;Heptafluorobutylamine;1-Butanamine, 2,2,3,3,4,4,4-heptafluoro-;BRN 1761906;EINECS 206-780-0;AI3-17127;Butylamine, 2,2,3,3,4,4,4-heptafluoro-;1H,1H-Perfluorobutylamine;SCHEMBL879849;DTXSID10190840;C4-H4-F7-N;BBL100672;MFCD00014817;STL554466;AKOS005254975;BS-22776;LS-47413;2,2,3,3,4,4,4-heptafluorobutylammonium;FT-0609064;H1300;2,2,3,3,4,4,4-Heptafluorobutylamine, 96%;A823704

Chemical Property of 2,2,3,3,4,4,4-Heptafluorobutylamine

Chemical Property:

• Appearance/Colour: clear colorless liquid
• Vapor Pressure: 153mmHg at 25°C
• Refractive Index: 1.296-1.298
• Boiling Point: 66.3 °C at 760 mmHg
• PKA: 5.89±0.30(Predicted)
• Flash Point: 5.2 °C
• PSA: 26.02000
• Density: 1.458 g/cm³
• LogP: 2.47830
• Water Solubility.: Soluble in water.
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 2
• Exact Mass: 199.02319627
• Heavy Atom Count: 12
• Complexity: 159

Purity/Quality:

98%,99%, ^*data from raw suppliers

2,2,3,3,4,4,4-Heptafluorobutylamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C,Xi
• Hazard Codes: C,Xi
• Statements: 34
• Safety Statements: 45-36/37/39-26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Nitrogen Compounds -> Halogenated Aliphatic Amines
• Canonical SMILES: C(C(C(C(F)(F)F)(F)F)(F)F)N
• Uses: 2,2,3,3,4,4,4-Heptafluorobutylamine is used as pharmaceutical intermediates

Technology Process of 2,2,3,3,4,4,4-Heptafluorobutylamine

There total 3 articles about 2,2,3,3,4,4,4-Heptafluorobutylamine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

heptafluorobutyramide (662-50-0) → 2,2,3,3,4,4,4-heptafluorobutylamine (374-99-2)

Guidance literature:

With lithium aluminium tetrahydride; diethyl ether;

DOI:10.1021/ja01141a060

Reference yield:

N-benzylidene-4,4,4,3,3,2,2-heptafluorobutylamine → 2,2,3,3,4,4,4-heptafluorobutylamine (374-99-2)

Guidance literature:

Hydrolysis;

DOI:10.1016/j.jfluchem.2009.10.013

Reference yield:

→ 2,2,3,3,4,4,4-heptafluorobutylamine (374-99-2)

Guidance literature:

RCN/ Red.;

upstream raw materials:

heptafluorobutyramide

Downstream raw materials:

2,6-dibromo-N,N'-bis(1H,1H-perfluorobutyl)naphthalene[1,8:4,5]bis(dicarboximide)

C₁₈H₄Br₂F₁₄N₂O₄

N₄-(2,2,3,3,4,4,4-heptafluoro-butyl)-N₂-[3-methoxy-4-(4-methyl-imidazol-1-yl)-phenyl]-6-methyl-pyrimidine-2,4-diamine

N-(1H,1H-heptafluoro-butyl)-acrylamide

Refernces

• 1、 Bowler,Lilley,Pittam,Wakeling. "Novel steroidal pure antiestrogens". . p. 71 - 99. Retrieved 2007/10/02.