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tert-Butyl chloroacetate

CAS No.
107-59-5
Chemical Name:
tert-Butyl chloroacetate
Synonyms
153N-6;NSC 87891;ClCH2C(O)OC(CH3)3;(10E)-3-O-De(αtert-Butyl chloroace;T-BUTYL CHLOROACETATE;TERT-BUTYL CHLORACETATE;3-Formyl Tyrosol αreft-Butyl chloroacetate;TERT-BUTYL CHLOROACETATE
CBNumber:
CB7749461
Molecular Formula:
C6H11ClO2
Molecular Weight:
150.6
MDL Number:
MFCD00000930
MOL File:
107-59-5.mol
MSDS File:
SDS
Last updated:2023-10-13 18:16:27

tert-Butyl chloroacetate Properties

Boiling point 48-49 °C/11 mmHg (lit.)
Density 1.053 g/mL at 25 °C (lit.)
refractive index n20/D 1.423(lit.)
Flash point 116 °F
storage temp. Flammables area
form Liquid
color Clear colorless to yellow
Specific Gravity 1.053
Water Solubility <0.1 g/L (20 ºC)
Merck 14,1563
BRN 1753006
LogP 2.07
CAS DataBase Reference 107-59-5(CAS DataBase Reference)
FDA UNII 05TMW98298
NIST Chemistry Reference Acetic acid, chloro-, 1,1-dimethylethyl ester(107-59-5)
EPA Substance Registry System Acetic acid, chloro-, 1,1-dimethylethyl ester (107-59-5)

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictogramsGHS hazard pictogramsGHS hazard pictogramsGHS hazard pictogramsGHS hazard pictograms
GHS07,GHS02,GHS05,GHS06,GHS09
Signal word  Danger
Hazard statements  H302+H312+H332-H315-H319-H302-H312-H335-H400-H410-H226-H302+H312-H314-H331
Precautionary statements  P273-P280h-P309-P501a-P261-P280-P305+P351+P338-P310-P210-P233-P240-P241+P242+P243-P264-P270-P271-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P370+P378-P403+P235-P501
Hazard Codes  C,N,Xn,Xi,F
Risk Statements  20/21/22-34-50/53-36/37/38-10
Safety Statements  26-36/37/39-45-61-60-16-7/9
RIDADR  UN 2920 8/PG 2
WGK Germany  3
RTECS  AF8985500
19-21
TSCA  Yes
HazardClass  3
PackingGroup  III
HS Code  29154000
Toxicity rat,LC50,inhalation,4738mg/m3/4H (4738mg/m3),SENSE ORGANS AND SPECIAL SENSES: OTHER CHANGES: OLFACTIONLUNGS, THORAX, OR RESPIRATION: DYSPNEABEHAVIORAL: TREMOR,International Journal of Toxicology. Vol. 19, Pg. 333, 2000.
NFPA 704
2
3 0

tert-Butyl chloroacetate price More Price(21)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich 186791 tert-Butyl chloroacetate 97% 107-59-5 25g $46.8 2024-03-01 Buy
Sigma-Aldrich 186791 tert-Butyl chloroacetate 97% 107-59-5 100g $83.2 2024-03-01 Buy
TCI Chemical C1267 tert-Butyl Chloroacetate >97.0%(GC) 107-59-5 25mL $33 2024-03-01 Buy
TCI Chemical C1267 tert-Butyl Chloroacetate >97.0%(GC) 107-59-5 500mL $94 2024-03-01 Buy
Alfa Aesar A15833 tert-Butyl chloroacetate, 98% 107-59-5 25g $26.65 2024-03-01 Buy
Product number Packaging Price Buy
186791 25g $46.8 Buy
186791 100g $83.2 Buy
C1267 25mL $33 Buy
C1267 500mL $94 Buy
A15833 25g $26.65 Buy

tert-Butyl chloroacetate Chemical Properties,Uses,Production

Chemical Properties

clear colorless to yellow liquid. Hydrolysis generates tert-butanol and chloroacetic acid.

Uses

tert-Butyl chloroacetate is used in the synthesis of imidazol-1-yl-acetic acid hydrochloride, cis-disubstituted aziridine ester via aza-Darzens reaction and 1,10-diaza-18-crown-6 based sensors bearing a coumarin fluorophore.

Uses

In the glycidic ester condensation.

Preparation

tert-Butyl chloroacetate synthesis: The tert-butanol was added to the mixture of chloroacetyl chloride and N,N-dimethylaniline, and the temperature was kept below 30°C. The reactant was poured into water, washed and dried, and then fractionated under reduced pressure. The fractions at 48-49°C (1.46kPa) were collected to obtain tert-butyl chloroacetate with a yield of 63%.

Safety Profile

A poison by ingestion. Moderately toxic by inhalation skin contact. S severe sluin and moderate eye irritant. When heated to decomposition it emits toxic vapors of Cl-.

Purification Methods

Check the NMR spectrum; if satisfactory then distil in a vacuum; if not then dissolve in Et2O, wash with H2O, 10% H2SO4 until the acid extract does not become cloudy when made alkaline with NaOH. Wash the organic layer again with H2O, then saturated aqueous NaHCO3, dry over Na2SO4, evaporate and fractionate it through a carborundum-packed column or a 6-inch Widmer column (p 11, see tert-butyl ethyl malonate for precautions to avoid decomposition during disillation). [Johnson et al. J Am Chem Soc 75 4995 1953, Baker Org Synth Coll Vol III 144 1944, Beilstein 2 III 444.]

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View Lastest Price from tert-Butyl chloroacetate manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
tert-Butyl chloroacetate pictures 2024-04-26 tert-Butyl chloroacetate
107-59-5
US $0.00 / KG 1KG 99% 1000mt/year Jinan Finer Chemical Co., Ltd
tert-Butyl chloroacetate pictures 2023-10-14 tert-Butyl chloroacetate
107-59-5
US $0.00 / kg 1kg 0.985 20tons Hebei Yanxi Chemical Co., Ltd.
tert-Butyl chloroacetate pictures 2023-08-18 tert-Butyl chloroacetate
107-59-5
US $0.00 / KG 1KG 99% 50000KG/month Hebei Mojin Biotechnology Co., Ltd
Acetic acid, chloro-, tert-butyl ester aceticacid,chloro-,1,1-dimethylethylester ClCH2C(O)OC(CH3)3 tert-Butyl chloroacetate,97% tert-Butyl chloroacetate,99% tert-Butyl chloroace tert-Butyl chloroacetate, 97% 100GR NSC 87891 ChloroaceticAcidtert-ButylEste (InterMediate of Tert-Butyl Rosuvastatin) Aceticacid, 2-chloro-, 1,1-diMethylethyl ester tert-Butyl chloroacetate, 98+% 1,1-Dimethylethyl chloroacetate Chloroacetic acid 1,1-dimethylethyl ester Chloroacetic acid 1,1-dimethylethyl reft-Butyl chloroacetate T-BUTYL CHLOROACETATE TERT-BUTYL CHLORACETATE TERT-BUTYL CHLOROACETATE CHLOROACETIC ACID T-BUTYL ESTER CHLOROACETIC ACID TERT-BUTYL ESTER #ntert.-Butyl chloroacetate 1,4-Dimethyl-5H-pyrido[4,3-β]indol-3-amine-13C,15N Monoacetate 3-Amino-1,4-dimethyl-5h-pyrido[4,3-β]indole-13C2,15N Acetate Tert butyl chloro acetic acid -L-cladinose)-10-dehydro-11-dehydroxy-6-O-methyl-erythromycin 153N-6 Met-Pro-D-Phe-Arg-D-Trp-Phe-Lys-Pro-Val-NH2 MPFRWFKPV-NH2 MET-PRO-D-PHE-ARG-D-TRP-PHE-LYS-PRO-VAL-NH2MPFRWFKPV-NH2;153N-6;L-METHIONYL-L-PROLYL-D-PHENYLALANYL-L-ARGINYL-D-TRYPTOPHYL-L-PHENYLALANYL-L-LYSYL-L-PROLYL-L-VALINAMIDE; ACETATE 3-Formyl Tyrosol &alpha 4-O-Benzyl-3-acetyloxy Tyrosol &alpha (10E)-3-O-De(&alpha tert-Butyl Chloroacetate > 107-59-5 (TERT-BUTYL CHLOROACETATE) tert-Butyl Chloroacetate, ≥ 97.0% 107-59-5 54512-75-2 C1313C2H17N215NO2 C6H11ClO2 ClCH2CO2CCH33 ACETATE Esters Organic Building Blocks C6 to C7 Carbonyl Compounds Building Blocks Pharmaceutical intermediates API Intermediate API intermediates C6 to C7 Carbonyl Compounds Esters K00001