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Home > Encyclopedia > 1,3-Diethyl 2-ethyl-2-(1-methylbutyl)propanedioate

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

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

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

structure
  • CAS No:

    76-72-2

  • Formula:

    C14H26O4

  • Chemical Name:

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

  • Synonyms:

    Propanedioic acid,2-ethyl-2-(1-methylbutyl)-,1,3-diethyl ester;Malonic acid,ethyl(1-methylbutyl)-,diethyl ester;Propanedioic acid,ethyl(1-methylbutyl)-,diethyl ester;Malonic acid,ethyl(α-methylbutyl)-,diethyl ester;1,3-Diethyl 2-ethyl-2-(1-methylbutyl)propanedioate;NSC 10824

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

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

258.35

258.35

200-981-7

10824

Characteristics

52.60000

2.94520

0.986 g/cm3 @ Temp: 20 °C

155-157

120-122 °C @ Press: 8 Torr

114.2ºC

1.44

Safety Information

Xi

P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P337+P313, P362, P501

H302

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P337+P313, P362, and P501|Aggregated GHS information provided by 5 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:258.35
XLogP3:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:10
Exact Mass:258.18310931
Monoisotopic Mass:258.18310931
Topological Polar Surface Area:52.6
Heavy Atom Count:18
Complexity:255
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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