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Home > Encyclopedia > 4-propanoyl-1H-pyrrole-2-carboxylate

4-propanoyl-1H-pyrrole-2-carboxylate

4-propanoyl-1H-pyrrole-2-carboxylate structure

4-propanoyl-1H-pyrrole-2-carboxylate 

structure
  • CAS No:

    111468-94-1

  • Formula:

    C8H9NO3

  • Chemical Name:

    4-propanoyl-1H-pyrrole-2-carboxylate

  • Synonyms:

    4-propionyl-2-pyrrolecarboxylic acid;

4-propanoyl-1H-pyrrole-2-carboxylate Basic Attributes

167.16200

167.058243149

DTXSID80427675

2933990090

Characteristics

70.16000

1.30560

1.302g/cm3

216-220ºC

415.4ºC at 760mmHg

205ºC

1.21E-07mmHg at 25°C

Safety Information

Xi

Computed Properties

Molecular Weight:167.16
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:167.058243149
Monoisotopic Mass:167.058243149
Topological Polar Surface Area:70.2
Heavy Atom Count:12
Complexity:203
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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