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Home > Encyclopedia > 1H-Pyrrole-2-carboxylic acid, 4-acetyl-3,5-dimethyl-, ethyl ester

1H-Pyrrole-2-carboxylic acid, 4-acetyl-3,5-dimethyl-, ethyl ester

1H-Pyrrole-2-carboxylic acid, 4-acetyl-3,5-dimethyl-, ethyl ester structure

1H-Pyrrole-2-carboxylic acid, 4-acetyl-3,5-dimethyl-, ethyl ester 

structure
  • CAS No:

    2386-26-7

  • Formula:

    C11H15NO3

  • Chemical Name:

    1H-Pyrrole-2-carboxylic acid, 4-acetyl-3,5-dimethyl-, ethyl ester

  • Synonyms:

    1H-Pyrrole-2-carboxylic acid,4-acetyl-3,5-dimethyl-,ethyl ester;Pyrrole-2-carboxylic acid,4-acetyl-3,5-dimethyl-,ethyl ester;Ethyl-4-acetyl-3,5-dimethylpyrrole-2-carboxylate;NSC 10765;Ethyl 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate;3-Acetyl-2,4-dimethyl-5-carbethoxypyrrole

1H-Pyrrole-2-carboxylic acid, 4-acetyl-3,5-dimethyl-, ethyl ester Basic Attributes

209.24

209.24

MVH7P0EOA6

10765

DTXSID50178566

2933990090

Characteristics

59.2

2.37

1.1±0.1 g/cm3

143 °C @ Solvent: Methanol

359.2±42.0 °C at 760 mmHg

171.0±27.9 °C

1.522

H2O: Slightly soluble in water.

4.89E-05mmHg at 25°C

Safety Information

IRRITANT

20/21/22

22-36/37/39

UX9370900

Xi:Irritant;

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

|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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:209.24
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:209.10519334
Monoisotopic Mass:209.10519334
Topological Polar Surface Area:59.2
Heavy Atom Count:15
Complexity:265
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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