1,3-Diethyl 2-chloropropanedioate
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1,3-Diethyl 2-chloropropanedioate
structure -
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CAS No:
14064-10-9
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Formula:
C7H11ClO4
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Chemical Name:
1,3-Diethyl 2-chloropropanedioate
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Synonyms:
Propanedioic acid,2-chloro-,1,3-diethyl ester;Malonic acid,chloro-,diethyl ester;Propanedioic acid,chloro-,diethyl ester;1,3-Diethyl 2-chloropropanedioate;Chloromalonic acid diethyl ester;Diethyl chloromalonate;Ethyl chloromalonate;α-Chlorodiethyl malonate;Diethyl monochloromalonate;NSC 227952;Chloropropanedioic acid ethyl ester;Diethyl chloropropanedioate;Diethyl 2-chloromalonate;1448892-10-1
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CAS No:
1,3-Diethyl 2-chloropropanedioate Basic Attributes
194.61
194.61
237-913-0
8Y5J45M964
227952
DTXSID2022258
29171990
Characteristics
52.6
1.6
Clear colorless Liquid
1.204 g/mL at 25 °C(lit.)
222 °C
>230 °F
n 20/D 1.432(lit.)
-20°C Freezer, Under Inert Atmosphere
Safety Information
III
8
UN 3265 8/PG 2
3
34-36/37
26-27-28-36/37/39-45
C
P261-P273-P280-P305 + P351 + P338-P310
H314-H335-H400
|Danger|H314 (93.18%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P261, P264, P271, P273, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P363, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 44 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
1,3-Diethyl 2-chloropropanedioate Use and Manufacturing
A compound used in the models of aquatic toxicity developed
Propanedioic acid, 2-chloro-, 1,3-diethyl ester: INACTIVE
Computed Properties
Molecular Weight:194.61
XLogP3:1.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:194.0345865
Monoisotopic Mass:194.0345865
Topological Polar Surface Area:52.6
Heavy Atom Count:12
Complexity:151
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1,3-Diethyl 2-chloropropanedioate
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