TRANS-N-BOC-1,4-CYCLOHEXANEDIAMINE
- Product Name
- TRANS-N-BOC-1,4-CYCLOHEXANEDIAMINE
- CAS No.
- 177906-48-8
- Chemical Name
- TRANS-N-BOC-1,4-CYCLOHEXANEDIAMINE
- Synonyms
- N-BOC-TRANS-1,4-CYCLOHEXANEDIAMINE;trans-4-(Boc-amino)cyclohexanamine;N-Boc-transcyclohexanediamine;trans-4-(Boc-aMino)cyclohexylaMine;TRANS-N-BOC-1,4-CYCLOHEXANEDIAMINE;Trans-N-Boc-cyclohexane-1,4-diamine;1-N-BOC-TRANS-1,4-CYCLOHEXYLDIAMINE;Trans-1-N-Boc-1,4-Cyclohexanediamine;Trans-1N-Boc-cyclohexane-1,4-diamine;trans-4-(Boc-amino)cyclohexylamine,97%
- CBNumber
- CB1268261
- Molecular Formula
- C11H22N2O2
- Formula Weight
- 214.3
- MOL File
- 177906-48-8.mol
TRANS-N-BOC-1,4-CYCLOHEXANEDIAMINE Property
- Boiling point:
- 322.1±31.0 °C(Predicted)
- Density
- 1.02±0.1 g/cm3(Predicted)
- storage temp.
- under inert gas (nitrogen or Argon) at 2–8 °C
- form
- solid
- pka
- 12.44±0.40(Predicted)
- color
- White
- Water Solubility
- Slightly soluble in water.
- InChI
- InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13-9-6-4-8(12)5-7-9/h8-9H,4-7,12H2,1-3H3,(H,13,14)/t8-,9-
- InChIKey
- FEYLUKDSKVSMSZ-KYZUINATSA-N
- SMILES
- C(OC(C)(C)C)(=O)N[C@@H]1CC[C@@H](N)CC1
- CAS DataBase Reference
- 177906-48-8(CAS DataBase Reference)
Safety
- HS Code
- 2922498590
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P405Store locked up.
N-Bromosuccinimide Price
- Product number
- B646235
- Product name
- trans-N-Boc-1,4-cyclohexanediamine
- Packaging
- 1g
- Price
- $120
- Updated
- 2021/12/16
- Product number
- 239999
- Product name
- N-Boc-trans-1,4-cyclohexanediamine
- Packaging
- 1g
- Price
- $289
- Updated
- 2021/12/16
- Product number
- OR7177
- Product name
- trans-Cyclohexane-1,4-diamine,N-BOCprotected
- Packaging
- 1g
- Price
- $16
- Updated
- 2021/12/16
- Product number
- 073418
- Product name
- trans-N-Boc-1,4-cyclohexanediamine
- Purity
- 95+%
- Packaging
- 1g
- Price
- $22
- Updated
- 2021/12/16
- Product number
- CS-B0868
- Product name
- tert-Butyltrans-N-(4-aminocyclohexyl)carbamate
- Purity
- ≥98.0%
- Packaging
- 5g
- Price
- $34
- Updated
- 2021/12/16
TRANS-N-BOC-1,4-CYCLOHEXANEDIAMINE Chemical Properties,Usage,Production
Uses
trans-4-(Boc-amino)cyclohexylamine is used in the preparation of orally bioavailable and selective V1A receptor antagonist.
Uses
trans-N-Boc-1,4-cyclohexanediamine is used in the preparation of orally bioavailable and selective V1A receptor antagonist.
Synthesis
24424-99-5
2615-25-0
177906-48-8
Example 17. General procedure for the synthesis of tert-butyl trans-(4-aminocyclohexyl)carbamate (SB1-E-21-1) from di-tert-butyl dicarbonate and trans-1,4-cyclohexanediamine: To a methanol (100 mL) solution of SM-21-1 (2.0 g, 17.5 mmol) was slowly added dropwise a methanol (60 mL) solution of di-tert-butyl dicarbonate (1.1 g, 5.04 mmol). ) solution in methanol (60 mL) for 30 minutes. The reaction mixture was stirred at room temperature overnight. Upon completion of the reaction, the solvent was removed by concentration under reduced pressure. Water (50 mL) was added to the residue and stirring was continued for 20 minutes at room temperature, followed by filtration. The filtrate was extracted with ethyl acetate (120 mL x 2), and the organic phases were combined and washed sequentially with water (50 mL x 2) and saturated saline (50 mL x 2). The organic phase was dried with anhydrous sodium sulfate, filtered, and concentrated under reduced pressure to remove the solvent to afford the target product SB1-E-21-1 (off-white solid, 900 mg, 83% yield).
References
[1] Chemistry - An Asian Journal, 2010, vol. 5, # 4, p. 877 - 886
[2] Patent: WO2016/160617, 2016, A2. Location in patent: Paragraph 00401
[3] Journal of Organic Chemistry, 1996, vol. 61, # 25, p. 8811 - 8818
[4] Patent: WO2016/116563, 2016, A1. Location in patent: Page/Page column 34-35
[5] Patent: WO2008/57468, 2008, A1. Location in patent: Page/Page column 352
TRANS-N-BOC-1,4-CYCLOHEXANEDIAMINE Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from TRANS-N-BOC-1,4-CYCLOHEXANEDIAMINE manufacturers
- Product
- TRANS-N-BOC-1,4-CYCLOHEXANEDIAMINE 177906-48-8
- Price
- US $8.50/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 15MT
- Release date
- 2023-09-15
- Product
- N-Boc-transcyclohexanediamine 177906-48-8
- Price
- US $8.60/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 15MT
- Release date
- 2023-09-15
- Product
- Trans-1-(N-Boc AMino)-4-AMino cyclohexane 177906-48-8
- Price
- US $8.90/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 15MT
- Release date
- 2023-09-15