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Home > Encyclopedia > 1,3-Diethyl 2,2-dipropylpropanedioate

1,3-Diethyl 2,2-dipropylpropanedioate

1,3-Diethyl 2,2-dipropylpropanedioate structure

1,3-Diethyl 2,2-dipropylpropanedioate 

structure
  • CAS No:

    6065-63-0

  • Formula:

    C13H24O4

  • Chemical Name:

    1,3-Diethyl 2,2-dipropylpropanedioate

  • Synonyms:

    Propanedioic acid,2,2-dipropyl-,1,3-diethyl ester;Malonic acid,dipropyl-,diethyl ester;Propanedioic acid,dipropyl-,diethyl ester;1,3-Diethyl 2,2-dipropylpropanedioate;Diethyl dipropylmalonate;Diethyl 2,2-dipropylmalonate;NSC 163902

  • Categories:

    Active Pharmaceutical Ingredients  >  Other Chemical Drugs

Description

Light Yellow Oil

1,3-Diethyl 2,2-dipropylpropanedioate Basic Attributes

244.327

244.33

227-998-2

163902

DTXSID7057783

2917190090

Characteristics

52.60000

3.53

Clear liquid

1.0±0.1 g/cm3

127 °C @ Press: 4 Torr

113.7±16.9 °C

1.439

Safety Information

S24/25

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P312, P321, P330, P332+P313, P362, P403+P233, P405, P501

H302

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

1,3-Diethyl 2,2-dipropylpropanedioate Use and Manufacturing

Diethyl dipropylmalonate is used in the preparation of Valporic Acid (V094750).

Computed Properties

Molecular Weight:244.33
XLogP3:3.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:10
Exact Mass:244.16745924
Monoisotopic Mass:244.16745924
Topological Polar Surface Area:52.6
Heavy Atom Count:17
Complexity:222
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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