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tert-Butyl propionate

tert-Butyl propionate structure

tert-Butyl propionate 

structure
  • CAS No:

    20487-40-5

  • Formula:

    C7H14O2

  • Chemical Name:

    tert-Butyl propionate

  • Synonyms:

    Propanoic acid,1,1-dimethylethyl ester;Propionic acid,tert-butyl ester;tert-Butyl propionate;1,1-Dimethylethyl propionate;tert-Butyl propanoate;Propionic acid tert-butyl ester

  • Categories:

    Organic Chemistry  >  Carboxylic Acids and Derivatives

tert-Butyl propionate Basic Attributes

130.18

130.18

606-566-0

43953CC10D

DTXSID20174459

2915509000

Characteristics

26.30000

1.73810

0.8647 g/cm3 @ Temp: 20 °C

-89.5ºC

118.25 °C

21 °C

n20/D 1.393(lit.)

Safety Information

II

3.1

UN 2394 3/PG 3

2

10-36/37/38-11

16-36/37/39-26

UF4930000

F,Xi

P210

H225

|Danger|H225: Highly Flammable liquid and vapor [Danger Flammable liquids]|P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501|H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]|Aggregated GHS information provided by 39 companies from 1 notifications to the ECHA C&L Inventory.

tert-Butyl propionate Use and Manufacturing

Food additives -> Flavoring Agents

Flavoring Agents

Computed Properties

Molecular Weight:130.18
XLogP3:1.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:130.099379685
Monoisotopic Mass:130.099379685
Topological Polar Surface Area:26.3
Heavy Atom Count:9
Complexity:100
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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