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ChemicalBook > Product Catalogue >Organic Chemistry >Carboxylic acids and derivatives >Carboxylic acid esters and derivatives >tert-Butyl cyanoacetate

tert-Butyl cyanoacetate

tert-Butyl cyanoacetate Structure
  • ₹3521 - ₹25420
  • Product name: tert-Butyl cyanoacetate
  • CAS: 1116-98-9
  • MF: C7H11NO2
  • MW: 141.17
  • EINECS:214-243-7
  • MDL Number:MFCD00001938
  • Synonyms:TERT-BUTYL CYANOACETATE;T-BUTYL CYANOACETATE;CYANOACETIC ACID TERT-BUTYL ESTER;aceticacid,cyano-,1,1-dimethylethylester ;Cyanoaceticacidbutylester;3-Oxo-3-tert-butoxypropanenitrile;Cyanoacetic acid 1,1-dimethylethyl ester;Tert-butyl cyanoacet
6 prices
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Brand

  • ALFA India
  • TCI Chemicals (India)
  • Sigma-Aldrich(India)

Package

  • 5g
  • 10ML
  • 25ML
  • 25g
  • 100g
  • 250ML
  • ManufacturerALFA India
  • Product numberALF-L00123-06
  • Product descriptiontert-Butyl cyanoacetate, 98%
  • Packaging5g
  • Price₹3521
  • Updated2022-05-26
  • Buy
  • ManufacturerALFA India
  • Product numberALF-L00123-14
  • Product descriptiontert-Butyl cyanoacetate, 98%
  • Packaging25g
  • Price₹5819
  • Updated2022-05-26
  • Buy
  • ManufacturerALFA India
  • Product numberALF-L00123-22
  • Product descriptiontert-Butyl cyanoacetate, 98%
  • Packaging100g
  • Price₹25420
  • Updated2022-05-26
  • Buy
  • ManufacturerTCI Chemicals (India)
  • Product numberC1441
  • Product descriptiontert-Butyl Cyanoacetate min. 97.0 %
  • Packaging25ML
  • Price₹9500
  • Updated2022-05-26
  • Buy
  • ManufacturerTCI Chemicals (India)
  • Product numberC1441
  • Product descriptiontert-Butyl Cyanoacetate min. 97.0 %
  • Packaging250ML
  • Price₹13700
  • Updated2022-05-26
  • Buy
  • ManufacturerSigma-Aldrich(India)
  • Product number28440
  • Product descriptiontert-Butyl cyanoacetate ≥97.0% (GC)
  • Packaging10ML
  • Price₹6116.13
  • Updated2022-06-14
  • Buy
Manufacturer Product number Product description Packaging Price Updated Buy
ALFA India ALF-L00123-06 tert-Butyl cyanoacetate, 98% 5g ₹3521 2022-05-26 Buy
ALFA India ALF-L00123-14 tert-Butyl cyanoacetate, 98% 25g ₹5819 2022-05-26 Buy
ALFA India ALF-L00123-22 tert-Butyl cyanoacetate, 98% 100g ₹25420 2022-05-26 Buy
TCI Chemicals (India) C1441 tert-Butyl Cyanoacetate min. 97.0 % 25ML ₹9500 2022-05-26 Buy
TCI Chemicals (India) C1441 tert-Butyl Cyanoacetate min. 97.0 % 250ML ₹13700 2022-05-26 Buy
Sigma-Aldrich(India) 28440 tert-Butyl cyanoacetate ≥97.0% (GC) 10ML ₹6116.13 2022-06-14 Buy

Properties

Boiling point :40-42 °C/0.1 mmHg (lit.)
Density :0.988 g/mL at 20 °C (lit.)
refractive index :n20/D 1.420
Flash point :91°C
storage temp. :2-8°C
solubility :Difficult to mix.
pka :3.21±0.10(Predicted)
form :Oil
color :Clear Colorless
BRN :1755933
InChI :InChI=1S/C7H11NO2/c1-7(2,3)10-6(9)4-5-8/h4H2,1-3H3
InChIKey :BFNYNEMRWHFIMR-UHFFFAOYSA-N
SMILES :C(OC(C)(C)C)(=O)CC#N
CAS DataBase Reference :1116-98-9(CAS DataBase Reference)
EPA Substance Registry System :Acetic acid, cyano-, 1,1-dimethylethyl ester (1116-98-9)

Safety Information

Symbol(GHS): GHS hazard pictograms
Signal word: Warning
Hazard statements:
Code Hazard statements Hazard class Category Signal word Pictogram P-Codes
H227 Combustible liquid Flammable liquids Category 4 Warning P210, P280, P370+P378, P403+P235,P501
H302 Harmful if swallowed Acute toxicity,oral Category 4 Warning GHS hazard pictograms P264, P270, P301+P312, P330, P501
H315 Causes skin irritation Skin corrosion/irritation Category 2 Warning GHS hazard pictograms P264, P280, P302+P352, P321,P332+P313, P362
H319 Causes serious eye irritation Serious eye damage/eye irritation Category 2A Warning GHS hazard pictograms P264, P280, P305+P351+P338,P337+P313P
Precautionary statements:
P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P264 Wash hands thoroughly after handling.
P264 Wash skin thouroughly after handling.
P270 Do not eat, drink or smoke when using this product.
P280 Wear protective gloves/protective clothing/eye protection/face protection.
P370+P378 In case of fire: Use … for extinction.
P403+P235 Store in a well-ventilated place. Keep cool.
P501 Dispose of contents/container to..…

Description

tert-Butyl cyanoacetate is used in the synthesis of vinylogous urea and tert-butyl phenylcyanoacrylates. It is also used as a new additive for the sugar nucleoside base coupling step en route to DAPD with improved β-selectivity.

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