1,4-Dimethyl 2-acetylbutanedioate
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1,4-Dimethyl 2-acetylbutanedioate
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CAS No:
10420-33-4
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Formula:
C8H12O5
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Chemical Name:
1,4-Dimethyl 2-acetylbutanedioate
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Synonyms:
Butanedioic acid,2-acetyl-,1,4-dimethyl ester;Succinic acid,acetyl-,dimethyl ester;Butanedioic acid,acetyl-,dimethyl ester;1,4-Dimethyl 2-acetylbutanedioate;Acetylsuccinic acid,dimethyl ester;Acetosuccinic acid,dimethyl ester;Dimethyl acetylsuccinate;Dimethyl 2-acetylsuccinate;2-Acetyl-succinic acid dimethyl ester;121952-83-8
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CAS No:
Characteristics
69.7
-0.2
1.16 g/mL at 25 °C(lit.)
32-32.5 °C
84 °C
>230 °F
1.430
30g/l OECD Test Guideline 105
Store below +30°C.
0.72-11.1%(V)
1,4-Dimethyl 2-acetylbutanedioate Use and Manufacturing
Used in the synthesis of dyes, food colors, tobacco flavors, etc.
Butanedioic acid, 2-acetyl-, 1,4-dimethyl ester: ACTIVE
Computed Properties
Molecular Weight:188.18
XLogP3:-0.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:188.06847348
Monoisotopic Mass:188.06847348
Topological Polar Surface Area:69.7
Heavy Atom Count:13
Complexity:221
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1,4-Dimethyl 2-acetylbutanedioate
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