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1-(1H-Imidazol-1-yl)-1-propanone

1-(1H-Imidazol-1-yl)-1-propanone structure

1-(1H-Imidazol-1-yl)-1-propanone 

structure
  • CAS No:

    4122-52-5

  • Formula:

    C6H8N2O

  • Chemical Name:

    1-(1H-Imidazol-1-yl)-1-propanone

  • Synonyms:

    1-Propanone,1-(1H-imidazol-1-yl)-;Imidazole,1-propionyl-;1H-Imidazole,1-(1-oxopropyl)-;1-(1H-Imidazol-1-yl)-1-propanone;1-Propionylimidazole;Propionylimidazolide;N-Propionylimidazole

Description

ChEBI: An N-acylimidazole compound having propanoyl as the acyl group.


N-propanoylimidazole is an N-acylimidazole compound having propanoyl as the acyl group.

1-(1H-Imidazol-1-yl)-1-propanone Basic Attributes

124.14100

124.14

223-922-7

DTXSID00194150

2933290090

Characteristics

34.89000

0.93330

1.1g/cm3

63-64 °C @ Solvent: Chloroform, Hexane

109ºC

94.5ºC

1.541

Safety Information

P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P312, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P370+P378, P403+P233, P403+P235, P405, P501

H226

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P312, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P370+P378, P403+P233, P403+P235, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:124.14
XLogP3:0.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:124.063662883
Monoisotopic Mass:124.063662883
Topological Polar Surface Area:34.9
Heavy Atom Count:9
Complexity:114
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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