1,3-Diethyl 2-butylpropanedioate
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1,3-Diethyl 2-butylpropanedioate
structure -
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CAS No:
133-08-4
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Formula:
C11H20O4
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Chemical Name:
1,3-Diethyl 2-butylpropanedioate
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Synonyms:
Propanedioic acid,2-butyl-,1,3-diethyl ester;Malonic acid,butyl-,diethyl ester;Propanedioic acid,butyl-,diethyl ester;1,3-Diethyl 2-butylpropanedioate;Diethyl butylmalonate;Diethyl n-butylmalonate;Butylmalonic acid diethyl ester;Ethyl butylmalonate;Diethyl α-butylmalonate;Diethyl 2-butylmalonate;Butylpropanedioic acid diethyl ester;NSC 4565;Diethyl 2-n-butylmalonate
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CAS No:
1,3-Diethyl 2-butylpropanedioate Basic Attributes
216.274
216.27
205-089-1
CYY2Q744WB
4565
DTXSID90157895
2917190090
Characteristics
52.60000
2.64
clear liquid
0.9745 g/cm3 @ Temp: 20 °C
238 °C
237.5 °C
93.9±0.0 °C
1.433
Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
0.0447mmHg at 25°C
Safety Information
NONH for all modes of transport
1
S24/25
Stable at room temperature in closed containers under normal storage and handling conditions.
P264, P280, P305+P351+P338, P33, P313
H319
|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 3 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:216.27
XLogP3:2.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:216.13615911
Monoisotopic Mass:216.13615911
Topological Polar Surface Area:52.6
Heavy Atom Count:15
Complexity:183
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1,3-Diethyl 2-butylpropanedioate
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