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Home > Encyclopedia > 1-(1H-IMIDAZOL-4-YL)-ETHANONEHCL

1-(1H-IMIDAZOL-4-YL)-ETHANONEHCL

1-(1H-IMIDAZOL-4-YL)-ETHANONEHCL structure

1-(1H-IMIDAZOL-4-YL)-ETHANONEHCL 

structure
  • CAS No:

    61985-25-9

  • Formula:

    C5H6N2O

  • Chemical Name:

    1-(1H-IMIDAZOL-4-YL)-ETHANONEHCL

  • Synonyms:

    1-(1H-IMIDAZOL-4-YL)-ETHANONE HCL;Ethanone, 1-(1H-imidazol-5-yl)-;4-ethoxy-1H-imidazole;1-(1H-imidazol-4-yl)ethanone;Ethanone, 1-(1H-imidazol-4-yl)- (9CI);1-(1H-iMidazol-4-yl)ethan-1-one;4-ACETYLIMIDAZOLE HYDROCHLORIDE;4-Acetyl-1H-imidazole

1-(1H-IMIDAZOL-4-YL)-ETHANONEHCL Basic Attributes

110.11

110.048012819 g/mol

DTXSID30340547

2933290090

Characteristics

45.75000

1.41430

1.190

169-170℃

329.4±15.0 °C(Predicted)

157.382ºC

11.34±0.10

Safety Information

IRRITANT

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:110.11
XLogP3:0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:110.048012819
Monoisotopic Mass:110.048012819
Topological Polar Surface Area:45.8
Heavy Atom Count:8
Complexity:103
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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