Cas no 80058-84-0 (4-bromo-2,6-bis(propan-2-yl)aniline)

4-bromo-2,6-bis(propan-2-yl)aniline structure
80058-84-0 structure
Product Name:4-bromo-2,6-bis(propan-2-yl)aniline
CAS No:80058-84-0
MF:C12H18BrN
MW:256.182022571564
MDL:MFCD09743895
CID:707590
PubChem ID:11780114
Update Time:2024-10-27

4-bromo-2,6-bis(propan-2-yl)aniline Chemical and Physical Properties

Names and Identifiers

    • 4-Bromo-2,6-diisopropylaniline
    • 4-BROMO-2,6-BIS(1-METHYLETHYL)BENZENAMINE
    • 4-bromo-2,6-di(propan-2-yl)aniline
    • 4-bromo-2,6-diisopropylbenzenamine
    • Benzenamine,4-bromo-2,6-bis(1-methylethyl)-
    • 2,6-diisopropyl-4-bromoaniline
    • QAQRHTYPYQPBSX-UHFFFAOYSA-N
    • 4-bromo-2,6-di-iso-propylaniline
    • 4-bromo-2,6-diisopropylphenylamine
    • AM83137
    • 4-bromo-2,6-bis(propan-2-yl)aniline
    • FCH1392459
    • 4-bromanyl-2,6-di(propan-2-yl)aniline
    • S723
    • AX8022661
    • 4-BROMO-
    • 4-Bromo-2,6-bis(1-methylethyl)benzenamine (ACI)
    • DS-12932
    • A839824
    • SCHEMBL636376
    • AKOS016846086
    • 80058-84-0
    • FT-0647278
    • B4113
    • CS-W019405
    • SY104405
    • MFCD09743895
    • Benzenamine, 4-bromo-2,6-bis(1-methylethyl)-
    • DTXSID40472464
    • 4-Bromo-2,5-diisopropylaniline; 4-Bromo-2,6-diisopropylphenylamine; 4-Bromo-2,6-bis(1-methylethyl)benzenamine
    • MDL： MFCD09743895
    • Inchi： 1S/C12H18BrN/c1-7(2)10-5-9(13)6-11(8(3)4)12(10)14/h5-8H,14H2,1-4H3
    • InChI Key： QAQRHTYPYQPBSX-UHFFFAOYSA-N
    • SMILES： BrC1C=C(C(C)C)C(N)=C(C(C)C)C=1

Computed Properties

  • Exact Mass: 255.06200
  • Monoisotopic Mass: 255.06226g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 161
  • 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
  • Topological Polar Surface Area: 26
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 4.2

Experimental Properties

  • Color/Form: No data available
  • Density: 1.231
  • Melting Point: No data available
  • Boiling Point: 110°C/0.14mmHg(lit.)
  • Flash Point: 135.5±26.5 °C
  • Refractive Index: 1.553
  • PSA: 26.02000
  • LogP: 4.85930

4-bromo-2,6-bis(propan-2-yl)aniline Security Information

4-bromo-2,6-bis(propan-2-yl)aniline Customs Data

  • HS CODE：2921420090
  • Customs Data：

    China Customs Code:

    2921420090

    Overview:

    2921420090 Other aniline derivatives and their salts. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    HS:2921420090 aniline derivatives and their salts VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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4-bromo-2,6-bis(propan-2-yl)aniline Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: N-Bromosuccinimide Solvents: Dimethylformamide ;  30 min, 0 °C; 1 h, 0 °C
Reference
Single-molecule electrical spectroscopy of organocatalysis
Yang, Chen; Zhang, Lei; Li, Huiping ; Guo, Yilin; Jia, Chuancheng; et al, Matter, 2021, 4(9), 2874-2885

Production Method 2

Reaction Conditions
1.1 Reagents: Bromine Solvents: Methanol ,  Dichloromethane ;  1.5 h, rt; 1 d, rt
Reference
Ring-Closing and Cross-Metathesis with Artificial Metalloenzymes Created by Covalent Active Site-Directed Hybridization of a Lipase
Basauri-Molina, Manuel; Verhoeven, Dide G. A.; van Schaik, Arnoldus J.; Kleijn, Henk; Klein Gebbink, Robertus J. M., Chemistry - A European Journal, 2015, 21(44), 15676-15685

Production Method 3

Reaction Conditions
1.1 Reagents: Tetrabutylammonium tribromide Solvents: Dichloromethane ;  30 min, rt
Reference
Monofunctional Hyperbranched Ethylene Oligomers
Wiedemann, Thomas; Voit, Gregor; Tchernook, Alexandra; Roesle, Philipp; Goettker-Schnetmann, Inigo; et al, Journal of the American Chemical Society, 2014, 136(5), 2078-2085

Production Method 4

Reaction Conditions
1.1 Reagents: Bromine Solvents: Methanol ,  Dichloromethane ;  2 h, rt; 24 h, rt
Reference
London Dispersion Interactions Rather than Steric Hindrance Determine the Enantioselectivity of the Corey-Bakshi-Shibata Reduction
Eschmann, Christian; Song, Lijuan; Schreiner, Peter R., Angewandte Chemie, 2021, 60(9), 4823-4832

Production Method 5

Reaction Conditions
1.1 Reagents: Bromine Solvents: Dichloromethane ;  -5 °C; -5 °C
1.2 Reagents: Sodium hydroxide Solvents: Water ;  pH 7
Reference
Synthesis of 2, 6-diisopropyl-4-phenoxyphenyl isocyanate
Fang, Yong-qin; Wu, An-bang, Changzhou Daxue Xuebao, 2012, 24(4), 24-27

Production Method 6

Reaction Conditions
1.1 Reagents: Tetrabutylammonium tribromide Solvents: Dichloromethane ;  30 min, rt
Reference
On-surface synthesis of ballbot-type N-heterocyclic carbene polymers
Ren, Jindong ; Koy, Maximilian ; Osthues, Helena ; Lammers, Bertram Schulze; Gutheil, Christian; et al, Nature Chemistry, 2023, 15(12), 1737-1744

Production Method 7

Reaction Conditions
1.1 Reagents: Bromine Solvents: Dichloromethane ;  0 °C; 30 min, rt
1.2 Reagents: Sodium thiosulfate Solvents: Water ;  15 min, rt
Reference
Introducing NacNac-Like Bis(4,6-isopropylbenzoxazol-2-yl)methanide in s-Block Metal Coordination
Koehne, Ingo; Graw, Nico; Teuteberg, Thorsten; Herbst-Irmer, Regine; Stalke, Dietmar, Inorganic Chemistry, 2017, 56(24), 14968-14978

Production Method 8

Reaction Conditions
1.1 Reagents: Tetrabutylammonium tribromide Solvents: Dichloromethane ;  30 min, rt
Reference
Discovery of an iridacycle catalyst with improved reactivity and enantioselectivity in the hydrogenation of dialkyl ketimines
Schramm, York; Barrios-Landeros, Fabiola; Pfaltz, Andreas, Chemical Science, 2013, 4(7), 2760-2766

Production Method 9

Reaction Conditions
1.1 Reagents: Tetrabutylammonium tribromide Solvents: Dichloromethane ;  30 min, rt
Reference
Linear Hydroaminoalkylation Products from Alkyl-Substituted Alkenes
Warsitz, Michael; Doye, Sven, Chemistry - A European Journal, 2020, 26(66), 15121-15125

Production Method 10

Reaction Conditions
1.1 Reagents: Tetrabutylammonium bromide Solvents: Dichloromethane ;  30 min, rt
Reference
A functional Zn(II) metallacycle formed from an N-heterocyclic carbene precursor: a molecular sensor for selective recognition of Fe3+ and IO4- Ions
Kumar, Girijesh; Guda, Ramu; Husain, Ahmad ; Bodapati, Ramakrishna; Das, Samar K., Inorganic Chemistry, 2017, 56(9), 5017-5025

Production Method 11

Reaction Conditions
1.1 Reagents: Calcium carbonate ,  Tetrabutylammonium bromide Solvents: Methanol ;  overnight, rt
Reference
Highly active binuclear neutral nickel(II) catalysts affording high molecular weight polyethylene
Wehrmann, Peter; Mecking, Stefan, Organometallics, 2008, 27(7), 1399-1408

Production Method 12

Reaction Conditions
1.1 Reagents: Tetrabutylammonium tribromide Solvents: Dichloromethane ;  0.5 h, rt
Reference
Syntheses of sterically hindered pyridinium phenoxides as model compounds in nonlinear optics
Diemer, Vincent; Chaumeil, Helene; Defoin, Albert; Fort, Alain; Boeglin, Alex; et al, European Journal of Organic Chemistry, 2006, (12), 2727-2738

4-bromo-2,6-bis(propan-2-yl)aniline Raw materials

4-bromo-2,6-bis(propan-2-yl)aniline Preparation Products

4-bromo-2,6-bis(propan-2-yl)aniline Suppliers

Suzhou Senfeida Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:80058-84-0)4-BROMO-2,6-BIS(1-METHYLETHYL)BENZENAMINE
Order Number:sfd13212
Stock Status:in Stock
Quantity:200kg
Purity:99.9%
Pricing Information Last Updated:Friday, 19 July 2024 14:36
Price ($):discuss personally

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Suzhou Senfeida Chemical Co., Ltd
(CAS:80058-84-0)4-BROMO-2,6-BIS(1-METHYLETHYL)BENZENAMINE
sfd13212
Purity:99.9%
Quantity:200kg
Price ($):Inquiry
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