ChemicalBook > CAS DataBase List > 2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile
2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile
2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile
- CAS No.58632-95-4
- Chemical Name:2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile
- CBNumber:CB8741235
- Molecular Formula:C13H14N2O3
- Formula Weight:246.26
- MOL File:58632-95-4.mol
2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile Property
- Melting point 85-88 °C (lit.)
- Boiling point 389.26°C (rough estimate)
- Density 1.1855 (rough estimate)
- refractive index 1.6450 (estimate)
- storage temp. -20°C
- solubility Soluble in water or 1% acetic acid
- form Fine Crystalline Powder
- color White to slightly beige
- Water Solubility insoluble
- Sensitive Moisture Sensitive
- BRN 2217296
- CAS DataBase Reference 58632-95-4(CAS DataBase Reference)
- FDA UNII F039SLP7BB
- EPA Substance Registry System Benzeneacetonitrile, .alpha.-[[[(1,1-dimethylethoxy)carbonyl]oxy]imino]- (58632-95-4)
- UNSPSC Code 12352108
- NACRES NA.22
Safety
- Hazard Codes :Xn,Xi
- Risk Statements :36/37/38-20/21/22
- Safety Statements :22-24/25-36/37/39-26-36
- RIDADR :3276
- WGK Germany :3
- RTECS :DA0513600
- F :10-21
- TSCA :Yes
- HazardClass :6.1
- PackingGroup :III
- HS Code :29280090
-
NFPA 704:
1 2 0
-
Symbol(GHS)
- Signal wordDanger
- Hazard statements H301-H315-H319-H302-H312-H332-H335
- Precautionary statements P264-P270-P280-P301+P310+P330-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P405-P501-P261-P304+P340-P305+P351+P338-P501a
2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile Price
More Price(6)
- Brand: Sigma-Aldrich
- Product number: 193372
- Product name : 2-(Boc-oxyimino)-2-phenylacetonitrile
- Purity: 99%
- Packaging: 5G
- Price: ₹2522.23
- Updated: 2022/06/14
- Buy: Buy
- Brand: Sigma-Aldrich(India)
- Product number: 193372
- Product name : 2-(Boc-oxyimino)-2-phenylacetonitrile
- Purity: 99%
- Packaging: 5G
- Price: ₹2522.23
- Updated: 2022/06/14
- Buy: Buy
- Brand: Sigma-Aldrich(India)
- Product number: 193372
- Product name : 2-(Boc-oxyimino)-2-phenylacetonitrile
- Purity: 99%
- Packaging: 25G
- Price: ₹8237.83
- Updated: 2022/06/14
- Buy: Buy
- Brand: Sigma-Aldrich(India)
- Product number: 193372
- Product name : 2-(Boc-oxyimino)-2-phenylacetonitrile
- Purity: 99%
- Packaging: 100G
- Price: ₹33644.1
- Updated: 2022/06/14
- Buy: Buy
- Brand: TCI Chemicals (India)
- Product number: B0988
- Product name : 2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile
- Purity:
- Packaging: 5G
- Price: ₹2100
- Updated: 2022/05/26
- Buy: Buy
2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile Chemical Properties,Usage,Production
- Chemical Properties White to off-white microcrystalline powder
- Uses Widely used for protection of amino groups in peptide synthesis and multi-step organic synthesis of small molecules.
-
Synthesis Reference(s)
Organic Syntheses, Coll. Vol. 6, p. 199, 1988
Tetrahedron Letters, 16, p. 4393, 1975 DOI: 10.1016/S0040-4039(00)91133-X - Purification Methods Triturate the solid with 90% aqueous MeOH, filter, wash with 90% aqueous MeOH and dry it in a vacuum. Recrystallise it from MeOH (needles or plates), but use warm MeOH and cool to crystallise; do not boil as it decomposes slowly. IR has max 1785 (C=O) cm-1 and NMR (CDCl3) usually shows two tert-butyl singlets for syn and anti isomers. Store it in a brown bottle (fridge). It evolves CO2 at room temperature (stoppered bottle can explode!), but can be stored over silica gel which may extend its useful life to more than a year. [Itoh et al. Org Synth 59 95 1980.]
2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile Preparation Products And Raw materials
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- 2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile(58632-95-4)MS2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile(58632-95-4)1HNMR2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile(58632-95-4)13CNMR2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile(58632-95-4)IR12-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile(58632-95-4)IR22-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile(58632-95-4)Raman
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