Cas no 119647-69-7 (Ethyl 4-acetyl-1H-pyrrole-2-carboxylate)

Ethyl 4-acetyl-1H-pyrrole-2-carboxylate structure
119647-69-7 structure
Product Name:Ethyl 4-acetyl-1H-pyrrole-2-carboxylate
CAS No:119647-69-7
MF:C9H11NO3
MW:181.188542604446
MDL:MFCD09263957
CID:1101365
PubChem ID:15266295
Update Time:2025-04-20

Ethyl 4-acetyl-1H-pyrrole-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • 4-acetyl-1H-Pyrrole-2-carboxylic acid ethyl ester
    • ethyl 4-acetyl-1H-pyrrole-2-carboxylate
    • 1H-Pyrrole-2-carboxylic acid, 4-acetyl-, ethyl ester
    • Ethyl 4-acetylpyrrole-2-carboxylate
    • PHZSCVNFRGWVRI-UHFFFAOYSA-N
    • AB50260
    • AK601316
    • SCHEMBL4674699
    • MFCD09263957
    • A907533
    • DS-19701
    • 119647-69-7
    • AKOS006228653
    • DB-171318
    • DTXSID70570689
    • CS-0095281
    • ETHYL4-ACETYL-1H-PYRROLE-2-CARBOXYLATE
    • C71663
    • Ethyl 4-acetyl-1H-pyrrole-2-carboxylate
    • MDL： MFCD09263957
    • Inchi： 1S/C9H11NO3/c1-3-13-9(12)8-4-7(5-10-8)6(2)11/h4-5,10H,3H2,1-2H3
    • InChI Key： PHZSCVNFRGWVRI-UHFFFAOYSA-N
    • SMILES： O(CC)C(C1=CC(C(C)=O)=CN1)=O

Computed Properties

  • Exact Mass: 181.07389321g/mol
  • Monoisotopic Mass: 181.07389321g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 215
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.9
  • Topological Polar Surface Area: 59.2

Experimental Properties

  • Boiling Point: 348.6±27.0°C at 760 mmHg

Ethyl 4-acetyl-1H-pyrrole-2-carboxylate Security Information

Ethyl 4-acetyl-1H-pyrrole-2-carboxylate Pricemore >>

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Alichem
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NAN JING YAO SHI KE JI GU FEN Co., Ltd.
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PBTU982-1g
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Chemenu
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abcr
AB528750-250 mg
Ethyl 4-acetyl-1H-pyrrole-2-carboxylate; .
 119647-69-7
250MG
 €193.10 2023-07-10

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