1,1,1-Triethyl methanetricarboxylate
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1,1,1-Triethyl methanetricarboxylate
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CAS No:
6279-86-3
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Formula:
C10H16O6
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Chemical Name:
1,1,1-Triethyl methanetricarboxylate
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Synonyms:
Methanetricarboxylic acid,1,1,1-triethyl ester;Methanetricarboxylic acid,triethyl ester;1,1,1-Triethyl methanetricarboxylate;Tricarbethoxymethane;Triethyl methanetricarboxylate;Tris(ethoxycarbonyl)methane;Tri(ethoxycarbonyl)methane;Tricarboethoxymethane;Diethyl (carboethoxy)malonate;NSC 11006;Diethyl (ethoxycarbonyl)malonate;Diethyl 2-ethoxycarbonylmalonate;2-Ethoxycarbonyl-malonic acid diethyl ester
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CAS No:
1,1,1-Triethyl methanetricarboxylate Basic Attributes
232.232
232.23
228-477-2
11006
DTXSID50211866
2917190090
Characteristics
78.9
1.4
After melting, clear colorless solid.
1.104 g/cm3 @ Temp: 20 °C
29 °C
253 °C
118.3±18.2 °C
1.438
H2O: immiscible
Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
Safety Information
NONH for all modes of transport
3
S23-S24/25
Stable under normal temperatures and pressures.
1,1,1-Triethyl methanetricarboxylate Use and Manufacturing
Triethyl Methanetricarboxylate is used in the synthesis of novel inhibitors of Hsp90. It is also used in the preparation of novel dihydroquinoline-3-carboxylic acids that function as HIV-1 integrase i nhibitors.
Computed Properties
Molecular Weight:232.23
XLogP3:1.4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:232.09468823
Monoisotopic Mass:232.09468823
Topological Polar Surface Area:78.9
Heavy Atom Count:16
Complexity:217
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1,1,1-Triethyl methanetricarboxylate
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