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186791

tert-Butyl chloroacetate

97%

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About This Item

Linear Formula:
ClCH2COOC(CH3)3
CAS Number:
107-59-5
Molecular Weight:
150.60
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24851243
EC Number:
203-506-1
Beilstein/REAXYS Number:
1753006
MDL number:
MFCD00000930
Assay:
97%
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Quality Segment

200

assay

97%

refractive index

n20/D 1.423 (lit.)

bp

48-49 °C/11 mmHg (lit.)

density

1.053 g/mL at 25 °C (lit.)

functional group

chloro, ester

SMILES string

CC(C)(C)OC(=O)CCl

InChI

1S/C6H11ClO2/c1-6(2,3)9-5(8)4-7/h4H2,1-3H3

InChI key

KUYMVWXKHQSIAS-UHFFFAOYSA-N

Application

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

pictograms

FlameSkull and crossbones
GHS02,GHS06

signalword

Danger

Hazard Classifications

Acute Tox. 3 Inhalation - Acute Tox. 4 Dermal - Acute Tox. 4 Oral - Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2

wgk

WGK 1

flash_point_f

114.8 °F

flash_point_c

46 °C

ppe

Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter

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