Pentanedioic acid, 2-acetyl-, 1,5-diethyl ester
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Pentanedioic acid, 2-acetyl-, 1,5-diethyl ester
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CAS No:
1501-06-0
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Formula:
C11H18O5
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Chemical Name:
Pentanedioic acid, 2-acetyl-, 1,5-diethyl ester
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Synonyms:
Pentanedioic acid,2-acetyl-,1,5-diethyl ester;Glutaric acid,2-acetyl-,diethyl ester;Pentanedioic acid,2-acetyl-,diethyl ester;Diethyl α-acetylglutarate;Diethyl 2-acetylglutarate;NSC 42535;Diethyl 2-acetylpentanedioate;1,5-Diethyl 2-acetylpentanedioate;2-Acetyl-pentanedioic acid diethyl ester;80474-82-4
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CAS No:
Pentanedioic acid, 2-acetyl-, 1,5-diethyl ester Basic Attributes
230.25800
230.26
216-114-0
42535
2918300090
Characteristics
69.67000
1.09800
CLEAR COLOURLESS TO LIGHT YELLOW LIQUID
1.0695 g/cm3 @ Temp: 19 °C
140-142 °C @ Press: 7 Torr
>230 °F
n20/D 1.439(lit.)
0.00198mmHg at 25°C
Safety Information
NONH for all modes of transport
3
S24/25
|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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:230.26
XLogP3:0.9
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:230.11542367
Monoisotopic Mass:230.11542367
Topological Polar Surface Area:69.7
Heavy Atom Count:16
Complexity:259
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Pentanedioic acid, 2-acetyl-, 1,5-diethyl ester
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