2,5-Di-tert-butylaniline - CAS 21860-03-7
Catalog: |
BB017175 |
Product Name: |
2,5-Di-tert-butylaniline |
CAS: |
21860-03-7 |
Synonyms: |
2,5-ditert-butylaniline |
IUPAC Name: | 2,5-ditert-butylaniline |
Description: | 2,5-Di-tert-butylaniline (CAS# 21860-03-7) is a useful research chemical. |
Molecular Weight: | 205.34 |
Molecular Formula: | C14H23N |
Canonical SMILES: | CC(C)(C)C1=CC(=C(C=C1)C(C)(C)C)N |
InChI: | InChI=1S/C14H23N/c1-13(2,3)10-7-8-11(12(15)9-10)14(4,5)6/h7-9H,15H2,1-6H3 |
InChI Key: | NUZVLYNISQOZOW-UHFFFAOYSA-N |
Boiling Point: | 294.7 ℃ at 760 mmHg |
Melting Point: | 103-106 ℃ (lit.) |
Purity: | 95 % |
Density: | 0.912 g/cm3 |
MDL: | MFCD00010338 |
LogP: | 4.44500 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112614952-A | Organic electroluminescent device and display device | 20201215 |
CN-112490391-A | Organic electroluminescent device and display device | 20201130 |
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PMID | Publication Date | Title | Journal |
21353727 | 20110501 | Discovery of novel SERCA inhibitors by virtual screening of a large compound library | European journal of medicinal chemistry |
15477142 | 20041101 | Spectroscopic and electrochemical characterization of di-tert-butylated sterically hindered Schiff bases and their phenoxyl radicals | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
12659145 | 20020101 | Salt effects on the reactions of radical ion pairs formed by electron transfer quenching of triplet 2-methyl-1,4-naphthoquinone by amines. Optical flash photolysis and step-scan FTIR investigations | Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology |
Complexity: | 206 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.183049738 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.183049738 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.6 |
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