2-TERT-BUTYL-1,3-DIISOPROPYLISOUREA
Physical Form- Product Name
- 2-TERT-BUTYL-1,3-DIISOPROPYLISOUREA
- CAS No.
- 71432-55-8
- Chemical Name
- 2-TERT-BUTYL-1,3-DIISOPROPYLISOUREA
- Synonyms
- 2-TERT-BUTYL-1;3-DIISOPROPYLISOUREA;2-TERT-BUTYL-1,3-DIISOPROPYLISOUREA;O-tert-Butyl-N,N'-diisopropylisourea;O-tert-Butyl-N,N'-diisopropylisourea;O-tert-Butyl-N,N'-diisopropylisourea >tert-Butyl N,N'-diisopropylcarbamimidate;tert-Butyl N,N'-diisopropylimidocarbamate;N,N'-diisopropyltert-butoxymethanimidamide;tert-butyl N,N'-bis(1-methylethyl)imidocarbamate
- CBNumber
- CB8239657
- Molecular Formula
- C11H24N2O
- Formula Weight
- 200.32
- MOL File
- 71432-55-8.mol
2-TERT-BUTYL-1,3-DIISOPROPYLISOUREA Property
- Boiling point:
- 61°C/10mmHg(lit.)
- Density
- 0.89±0.1 g/cm3(Predicted)
- refractive index
- 1.4240-1.4280
- storage temp.
- Keep in dark place,Inert atmosphere,2-8°C
- pka
- 9.54±0.50(Predicted)
- form
- clear liquid
- color
- Colorless to Almost colorless
- InChI
- InChI=1S/C11H24N2O/c1-8(2)12-10(13-9(3)4)14-11(5,6)7/h8-9H,1-7H3,(H,12,13)
- InChIKey
- FESDUDPSRMWIDL-UHFFFAOYSA-N
- SMILES
- C(=NC(C)C)(OC(C)(C)C)NC(C)C
Safety
- HS Code
- 2925290090
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H302Harmful if swallowed
H315Causes skin irritation
H319Causes serious eye irritation
H332Harmful if inhaled
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P280Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
N-Bromosuccinimide Price
- Product number
- B4178
- Product name
- O-tert-Butyl-N,N'-diisopropylisourea
- Purity
- >98.0%(T)
- Packaging
- 1g
- Price
- $75
- Updated
- 2025/07/31
- Product number
- B4178
- Product name
- O-tert-Butyl-N,N'-diisopropylisourea
- Purity
- >98.0%(T)
- Packaging
- 5g
- Price
- $255
- Updated
- 2025/07/31
- Product number
- B692565
- Product name
- 2-tert-Butyl-1,3-diisopropylisourea
- Packaging
- 2.5g
- Price
- $160
- Updated
- 2021/12/16
- Product number
- B692565
- Product name
- 2-tert-Butyl-1,3-diisopropylisourea
- Packaging
- 25g
- Price
- $1260
- Updated
- 2021/12/16
- Product number
- 24355
- Product name
- 2-tert-Butyl-1,3-diisopropylisourea,96%(Assay)
- Purity
- 96%(Assay)
- Packaging
- 1G
- Price
- $39.2
- Updated
- 2021/12/16
2-TERT-BUTYL-1,3-DIISOPROPYLISOUREA Chemical Properties,Usage,Production
Physical Form
liquid
Uses
2-tert-Butyl-1,3-diisopropylisourea is a useful synthetic intermediate in the synthesis of 5-Oxo Atorvastatin tert-Butyl Ester (O847160) which is a Boc-protected derivative of Atorvastatin. 2-tert-Butyl-1,3-diisopropylisourea is also used as a reagent in the total synthesis of Citrafungin A which is an antifungal natural product.
Synthesis
693-13-0
75-65-0
71432-55-8
GENERAL STEPS: CuCl (63.4 mg, 0.64 mmol, 1 mol%) was added to a solution of N,N'-diisopropylcarbodiimide (10.0 mL, 63.9 mmol, 1.0 equiv) in tert-butanol (6.97 mL, 73.5 mmol, 1.15 equiv). The reaction mixture was stirred at room temperature for 14 hours. After completion of the reaction, purification was carried out by distillation under reduced pressure (80°C, 25 mmHg). 2-tert-butyl-1,3-diisopropylisourea was obtained as a colorless oil (10.4 g, 51.9 mmol, 81% yield). The product was characterized by 1H NMR (300 MHz, CDCl3): δ 3.80-3.58 (1H, m, CH), 3.31-2.97 (1H, m, CH), 1.44 (9H, s, tBu), 1.19-1.01 (12H, m, Me2×2).
References
[1] Organic Letters, 2005, vol. 7, # 13, p. 2615 - 2618
[2] Chemistry - A European Journal, 2007, vol. 13, # 30, p. 8543 - 8563
[3] Beilstein Journal of Organic Chemistry, 2011, vol. 7, p. 1486 - 1493
[4] Journal of Medicinal Chemistry, 2015, vol. 58, # 10, p. 4204 - 4219
[5] Patent: EP2952517, 2015, A1. Location in patent: Paragraph 0217
2-TERT-BUTYL-1,3-DIISOPROPYLISOUREA Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 2-TERT-BUTYL-1,3-DIISOPROPYLISOUREA manufacturers
- Product
- 2-TERT-BUTYL-1,3-DIISOPROPYLISOUREA 71432-55-8
- Price
- US $1.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 1000KGS
- Release date
- 2019-12-25