tert-Butyl N-(4-aminobutyl)carbamate
- Product Name
- tert-Butyl N-(4-aminobutyl)carbamate
- CAS No.
- 68076-36-8
- Chemical Name
- tert-Butyl N-(4-aminobutyl)carbamate
- Synonyms
- N-BOC-1,4-BUTANEDIAMINE;N-BOC-1,4-DIAMINOBUTANE;N-(TERT-BUTOXYCARBONYL)-1,4-DIAMINOBUTANE;BOC-DAB HCL;AURORA KA-4397;Boc-NH-(CH2)4-NH2;BUTTPARK 121\06-09;RARECHEM AR PA 0023;BOC-NH(CH2)4NH2 HCL;BOC-DIAMINOBUTANE HCL
- CBNumber
- CB0166423
- Molecular Formula
- C9H20N2O2
- Formula Weight
- 188.27
- MOL File
- 68076-36-8.mol
tert-Butyl N-(4-aminobutyl)carbamate Property
- Boiling point:
- 292.9±23.0 °C(Predicted)
- Density
- 0.984 g/mL at 20 °C(lit.)
- refractive index
- n20/D 1.460
- Flash point:
- 109 °C
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- solubility
- Chloroform, DMSO, Methanol
- pka
- 12.86±0.46(Predicted)
- form
- Liquid
- color
- Clear colorless to light yellow
- BRN
- 1937878
- InChI
- InChI=1S/C9H20N2O2/c1-9(2,3)13-8(12)11-7-5-4-6-10/h4-7,10H2,1-3H3,(H,11,12)
- InChIKey
- ZFQWJXFJJZUVPI-UHFFFAOYSA-N
- SMILES
- C(OC(C)(C)C)(=O)NCCCCN
- CAS DataBase Reference
- 68076-36-8(CAS DataBase Reference)
Safety
- Hazard Codes
- C
- Risk Statements
- 34-24
- Safety Statements
- 26-36/37/39-45
- RIDADR
- UN 2735 8/PG 3
- WGK Germany
- 3
- F
- 10-34
- HazardClass
- 8
- PackingGroup
- Ⅲ
- HS Code
- 29241990
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Danger
- Hazard statements
-
H314Causes severe skin burns and eye damage
- Precautionary statements
-
P280Wear protective gloves/protective clothing/eye protection/face protection.
P303+P361+P353IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P363Wash contaminated clothing before reuse.
P405Store locked up.
N-Bromosuccinimide Price
- Product number
- 15404
- Product name
- N-Boc-1,4-butanediamine
- Purity
- ≥97.0% (GC/NT)
- Packaging
- 1ml
- Price
- $82.6
- Updated
- 2025/07/31
- Product number
- 15404
- Product name
- N-Boc-1,4-butanediamine
- Purity
- ≥97.0% (GC/NT)
- Packaging
- 5ml
- Price
- $392
- Updated
- 2025/07/31
- Product number
- A1373
- Product name
- N-(tert-Butoxycarbonyl)-1,4-diaminobutane
- Purity
- >98.0%(GC)(T)
- Packaging
- 1g
- Price
- $64
- Updated
- 2025/07/31
- Product number
- A1373
- Product name
- N-(tert-Butoxycarbonyl)-1,4-diaminobutane
- Purity
- >98.0%(GC)(T)
- Packaging
- 5g
- Price
- $182
- Updated
- 2025/07/31
- Product number
- A1373
- Product name
- N-(tert-Butoxycarbonyl)-1,4-diaminobutane
- Purity
- >98.0%(GC)(T)
- Packaging
- 25g
- Price
- $607
- Updated
- 2025/07/31
tert-Butyl N-(4-aminobutyl)carbamate Chemical Properties,Usage,Production
Chemical Properties
Clear colourless viscous liquid
Uses
N-Boc-1,4-diaminobutane is used in preparation of pharmacologically active compounds, preparation of spermidine analogues and in introduction of a C4-spacer. It serve as intermediates of medicine.
Uses
suzuki reaction
reaction suitability
reagent type: cross-linking reagent
Synthesis
24424-99-5
110-60-1
68076-36-8
Synthesis of compound 19: 1,4-Butanediamine (1 g, 11.36 mmol, 5 eq.) was dissolved in dichloromethane (15 ml). To this solution was slowly added di-tert-butyl dicarbonate (Boc2O, 0.619 g, 2.83 mmol, 1 eq.) dissolved in dichloromethane (15 ml). The reaction mixture was stirred at room temperature for 16 hours. The reaction progression was monitored by thin layer chromatography (TLC, unfolding agent ratio CH2Cl2:MeOH:33% NH4OH aqueous solution = 8:2:0.2). Upon completion of the reaction, the reaction mixture was filtered to remove insoluble impurities and the filtrate was concentrated by rotary evaporator. The resulting oily residue was dissolved with ethyl acetate (15 ml) and washed with saturated sodium chloride solution (3 x 10 ml) to remove unreacted 1,4-butanediamine. The organic phase was dried over anhydrous sodium sulfate and concentrated under reduced pressure to give 0.520 g of yellow oily product in 97.65% yield. The structure of the product was confirmed by 1H NMR (400 MHz, CDCl3): δ 1.38 (s, 9H), 1.52-1.59 (m, 4H), 2.34 (brs, 2H, D2O exchange), 2.72-2.79 (m, 2H), 3.19-3.24 (m, 2H), 5.95 (brs, 1H, D2O exchange).
IC 50
Alkyl/ether
References
[1] Journal of Organic Chemistry, 1997, vol. 62, # 2, p. 411 - 416
[2] Organic Letters, 2001, vol. 3, # 8, p. 1205 - 1208
[3] Bioorganic and Medicinal Chemistry, 2009, vol. 17, # 20, p. 7145 - 7155
[4] Journal of Materials Chemistry, 2011, vol. 21, # 13, p. 4850 - 4860
[5] Organic Letters, 2015, vol. 17, # 22, p. 5626 - 5629
tert-Butyl N-(4-aminobutyl)carbamate Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from tert-Butyl N-(4-aminobutyl)carbamate manufacturers
- Product
- tert-Butyl N-(4-aminobutyl)carbamate 68076-36-8
- Price
- US $56.00/kg
- Min. Order
- 1kg
- Purity
- 0.99
- Supply Ability
- 10000
- Release date
- 2024-08-16
- Product
- tert-Butyl N-(4-aminobutyl)carbamate 68076-36-8
- Price
- US $0.00-0.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 20 mt
- Release date
- 2025-03-14
- Product
- tert-Butyl N-(4-aminobutyl)carbamate 68076-36-8
- Price
- US $5.00-2.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 10000kg
- Release date
- 2024-08-20