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275735

Sigma-Aldrich

2,5-Di-tert-butylaniline

99%

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About This Item

Linear Formula:
[(CH3)3C]2C6H3NH2
CAS Number:
21860-03-7
Molecular Weight:
205.34
Beilstein:
2691916
MDL number:
MFCD00010338
UNSPSC Code:
12352100
PubChem Substance ID:
24856668
NACRES:
NA.22

Quality Level

100

Assay

99%

form

powder

mp

103-106 °C (lit.)

SMILES string

CC(C)(C)c1ccc(c(N)c1)C(C)(C)C

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

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Application

2,5-Di-tert-butylaniline has been used in the preparation of:
  • new rigid bidentate nitrogen ligands 1,2-bis[(2,5-di-tert-butylphenyl)imino]acenaphthene (dtb-BIAN)
  • N-(2,5-di-tert-butylphenyl)perylene-3,4-dicarboximide

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Monomeric Magnesium and Calcium Complexes containing the Rigid, Dianionic 1, 2-Bis [(2, 5-di-tert-butylphenyl) imino] acenaphthene (dtb-BIAN) and 1, 2-Bis [(2-biphenyl) imino] acenaphthene (bph-BIAN) Ligands.
Fedushkin IL, et al.
Zeitschrift fur Anorganische und Allgemeine Chemie, 630(4), 501-507 (2004)
New perylenes for dye sensitization of TiO2.
Ferrere S and Gregg BA.
New. J. Chem., 26(9), 1155-1160 (2002)
Christopher Elam et al.
European journal of medicinal chemistry, 46(5), 1512-1523 (2011-03-01)
Two screening protocols based on recursive partitioning and computational ligand docking methodologies, respectively, were employed for virtual screens of a compound library with 345,000 entries for novel inhibitors of the enzyme sarco/endoplasmic reticulum calcium ATPase (SERCA), a potential target for

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