1,1-dimethylethyl dichloroacetate

Modify Date: 2025-08-25 20:03:38

1,1-dimethylethyl dichloroacetate Structure
1,1-dimethylethyl dichloroacetate structure
Common Name 1,1-dimethylethyl dichloroacetate
CAS Number 49653-47-6 Molecular Weight 185.04800
Density 1.199g/cm3 Boiling Point 182.6ºC at 760 mmHg
Molecular Formula C6H10Cl2O2 Melting Point N/A
MSDS N/A Flash Point 64.4ºC

 Names

Name tert-butyl 2,2-dichloroacetate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.199g/cm3
Boiling Point 182.6ºC at 760 mmHg
Molecular Formula C6H10Cl2O2
Molecular Weight 185.04800
Flash Point 64.4ºC
Exact Mass 184.00600
PSA 26.30000
LogP 2.13180
Index of Refraction 1.447
InChIKey FOLRKRMAFDGZRR-UHFFFAOYSA-N
SMILES CC(C)(C)OC(=O)C(Cl)Cl

 Synthetic Route

~96%

1,1-dimethylethyl dichloroacetate Structure

1,1-dimethyleth...

CAS#:49653-47-6

Literature: Concellon, Jose M.; Rodriguez-Solla, Humberto; Diaz, Pamela; Llavona, Ricardo Journal of Organic Chemistry, 2007 , vol. 72, # 12 p. 4396 - 4400

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1,1-dimethylethyl dichloroacetate Structure

1,1-dimethyleth...

CAS#:49653-47-6

Literature: Parham; Twelves Journal of Organic Chemistry, 1957 , vol. 22, p. 730,733

 Synonyms

Dichlor-essigsaeure-tert-butylester
dichloro-acetic acid tert-butyl ester
tert-butyl 2,2,-dichloroacetate
1,1-Dimethylethyl dichloroacetate
Acetic acid,dichloro-,1,1-dimethylethyl ester
t-butyl dichloroacetate
tert-butyl dichloroacetate
EINECS 256-412-8
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