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Home > Encyclopedia > tert-butyl 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate

tert-butyl 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate

tert-butyl 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate structure

tert-butyl 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate 

structure
  • CAS No:

    63040-83-5

  • Formula:

    C13H19NO3

  • Chemical Name:

    tert-butyl 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate

  • Synonyms:

    t-Butyl-2,4-dimethyl-3-acetylpyrrol-5-carboxylat; t-butyl 4-acetyl-3,5-dimethylpyrrole-2-carboxylate; 4-Acetyl-3,5-dimethyl-pyrrol-2-carbonsaeure-tert-butylester; 4-acetyl-3,5-dimethyl-pyrrole-2-carboxylic acid tert-butyl ester; tert-butyl 3,5-dimethyl-4-acetyl-2-pyrrolecarboxylate; tert-Butyl 4-acetyl-3,5-dimethyl-2-pyrrolecarboxylate; tert-butyl 4-acetyl-3,5-dimethylpyrrole-2-carboxylate;Expand

tert-butyl 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate Basic Attributes

237.29500

237.13649347 g/mol

157282

2933990090

Characteristics

59.16000

2.78940

1.082g/cm3

151-153ºC

371.8ºC

178.7ºC

1.513

Safety Information

R36/37/38

26-37/39

Xi

P261; P305 + P351 + P338

H315; H319; H335

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:237.29
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:237.13649347
Monoisotopic Mass:237.13649347
Topological Polar Surface Area:59.2
Heavy Atom Count:17
Complexity:319
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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