2-(Boc-oxyimino)-2-phenylacetonitrile

Base Information Edit

Chemical Name:2-(Boc-oxyimino)-2-phenylacetonitrile
CAS No.:58632-95-4
Deprecated CAS:103919-55-7,115721-57-8,154920-47-5
Molecular Formula:C13H14N2O3
Molecular Weight:246.266
Hs Code.:29280090
European Community (EC) Number:261-370-9
Nikkaji Number:J39.231F
Wikidata:Q27277458
Mol file:58632-95-4.mol

Synonyms:58632-95-4;2-(Boc-oxyimino)-2-phenylacetonitrile;Boc-on;2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile;CCRIS 2601;tert-Butyl alpha-cyanobenzylaminyl carbonate;2-Boc-oxyimino-2-phenylacetonitrile;EINECS 261-370-9;UNII-F039SLP7BB;2-(tert-Butoxycarbonyloximino)-2-phenylacetonitrile;Carbonic acid, (cyanophenylmethylene)azanyl 1,1-dimethylethyl ester;Benzeneacetonitrile, .alpha.-[[[(1,1-dimethylethoxy)carbonyl]oxy]imino]-;C13H14N2O3;F039SLP7BB;tert-butyl [(E)-[cyano(phenyl)methylidene]amino] carbonate;starbld0016994;2-(t-Butoxycarbonyloxyimino)-2-phenylacetonitrile;SCHEMBL209658;Carbonic acid (cyanophenylmethylene)azanyl 1,1-dimethylethyl ester;QQWYQAQQADNEIC-PTNGSMBKSA-N;BCP12953;AKOS015900579;AM83875;NSC 328381;AS-11753;LS-188663;2-(t-Butoxycarbonyloximino)-2-phenylacetonitrile;(Z)-N-(tert-butoxycarbonyloxy)benzimidoyl cyanide;A831956;W-105376;Q27277458;F0001-1534;([(tert-Butoxycarbonyl)oxy]imino)(cyano)methyl]benzene #;carbonic acid tert-butyl [(E)-[cyano(phenyl)methylidene]amino] ester

Suppliers and Price of 2-(Boc-oxyimino)-2-phenylacetonitrile

Supply Marketing:Edit

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Usbiological
BOC-ON
25g
$ 322.00

TRC
2-(tert-Butoxycarbonyloxyimino)phenylacetonitrile
25g
$ 95.00

TCI Chemical
2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile >98.0%(N)
25g
$ 66.00

TCI Chemical
2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile >98.0%(N)
5g
$ 22.00

Sigma-Aldrich
2-(Boc-oxyimino)-2-phenylacetonitrile 99%
5g
$ 35.40

Sigma-Aldrich
2-(Boc-oxyimino)-2-phenylacetonitrile 99%
25g
$ 127.00

Sigma-Aldrich
2-(Boc-oxyimino)-2-phenylacetonitrile 99%
100g
$ 381.00

Medical Isotopes, Inc.
2-(tert-Butoxycarbonyloxyimino)phenylacetonitrile
10 g
$ 360.00

Medical Isotopes, Inc.
2-(tert-Butoxycarbonyloxyimino)phenylacetonitrile
5 g
$ 345.00

JR MediChem
2-(Boc-oxyimino)-2-phenylacetonitrile 99%
1kg
$ 918.00

Total 106 raw suppliers

Chemical Property of 2-(Boc-oxyimino)-2-phenylacetonitrile Edit

Chemical Property:

Appearance/Colour:White to off-white microcrystalline powder
Vapor Pressure:0.000251mmHg at 25°C
Melting Point:85-88 °C(lit.)
Refractive Index:1.512
Boiling Point:324.1 °C at 760 mmHg
Flash Point:149.8 °C
PSA：71.68000
Density:1.08 g/cm³
LogP:2.86598
Storage Temp.:2-8°C
Sensitive.:Moisture Sensitive
Water Solubility.:insoluble
XLogP3:3.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:246.10044231
Heavy Atom Count:18
Complexity:367

Purity/Quality:

99.9% ^*data from raw suppliers

BOC-ON ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn, Xi
Hazard Codes:Xn,Xi
Statements: 36/37/38-20/21/22
Safety Statements: 22-24/25-36/37/39-26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC(C)(C)OC(=O)ON=C(C#N)C1=CC=CC=C1
Isomeric SMILES:CC(C)(C)OC(=O)O/N=C(/C#N)\C1=CC=CC=C1
Uses Widely used for protection of amino groups in peptide synthesis and multi-step organic synthesis of small molecules.

Technology Process of 2-(Boc-oxyimino)-2-phenylacetonitrile

There total 9 articles about 2-(Boc-oxyimino)-2-phenylacetonitrile which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 140-29-4
phenylacetonitrile

: 58632-95-4
2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile

Guidance literature:: Multi-step reaction with 2 steps

1: MeONO, NaOH

2: (i) PhNMe₂, (ii) /BRN= 906698/, Py

With sodium hydroxide; methyl nitrite;
DOI:10.1016/S0040-4039(00)91133-X