Monoethyl malonate
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Monoethyl malonate
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CAS No:
1071-46-1
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Formula:
C5H8O4
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Chemical Name:
Monoethyl malonate
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Synonyms:
Propanedioic acid,1-ethyl ester;Malonic acid,monoethyl ester;Propanedioic acid,monoethyl ester;Malonic acid,ethyl ester;Monoethyl malonate;Ethyl hydrogen malonate;Ethyl malonate;(Ethoxycarbonyl)acetic acid;Monoethyl hydrogen malonate;3-Ethoxy-3-oxopropanoic acid;Monoethyl propanedioate
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CAS No:
Characteristics
63.6
0.3
Pale yellow Liquid
1.0554 g/cm3 @ Temp: 10 °C
107-110 °C
104-105 °C @ Press: 12 Torr
>230 °F
1.436
Miscible with water, chloroform and other solvents.
0.0155mmHg at 25°C
Safety Information
NONH for all modes of transport
3
36/37/38
26-36
Xi
P261-P305 + P351 + P338
H315-H319-H335
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 47 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Monoethyl malonate Use and Manufacturing
Ethyl Hydrogen Malonate has been shown to impair brain mitochondrial succinate and malate transport. It is also found in the extract of Hericum erinaceus mushroom which shows antitumor effects in tumor-bearing mice.
Computed Properties
Molecular Weight:132.11
XLogP3:0.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:132.04225873
Monoisotopic Mass:132.04225873
Topological Polar Surface Area:63.6
Heavy Atom Count:9
Complexity:118
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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