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1,3-Diethyl 2-ethyl-2-(1-methylpropyl)propanedioate

1,3-Diethyl 2-ethyl-2-(1-methylpropyl)propanedioate structure

CAS No:
76-71-1
Formula:
C13H24O4
Chemical Name:
1,3-Diethyl 2-ethyl-2-(1-methylpropyl)propanedioate
Synonyms:
Propanedioic acid,2-ethyl-2-(1-methylpropyl)-,1,3-diethyl ester;Malonic acid,sec-butylethyl-,diethyl ester;Propanedioic acid,ethyl(1-methylpropyl)-,diethyl ester;1,3-Diethyl 2-ethyl-2-(1-methylpropyl)propanedioate;Diethyl 2-ethyl-2-sec-butylmalonate;NSC 10822

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1,3-Diethyl 2-ethyl-2-(1-methylpropyl)propanedioate Basic Attributes

Molecular Weight：

244.32700

Exact Mass：

244.33

EC Number：

200-980-1

NSC Number：

10822

Characteristics

PSA：

52.60000

XLogP3：

2.55510

Density：

0.975 g/cm3

Boiling Point：

133 °C @ Press: 48 Torr

Flash Point：

107.5ºC

Refractive Index：

1.437

Safety Information

Precautionary statement(s)：

P264, P270, P301+P312, P330, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:244.33
XLogP3:3.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:244.16745924
Monoisotopic Mass:244.16745924
Topological Polar Surface Area:52.6
Heavy Atom Count:17
Complexity:242
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,3-Diethyl 2-ethyl-2-(1-methylpropyl)propanedioate

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

1,3-Diethyl 2-ethyl-2-(1-methylpropyl)propanedioate

SDS

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