Cas no 37102-48-0 (2-methyl-1H-Pyrrole-3-carboxylic acid)

2-Methyl-1H-pyrrole-3-carboxylic acid is a heterocyclic organic compound featuring a pyrrole ring substituted with a methyl group at the 2-position and a carboxylic acid moiety at the 3-position. This structure makes it a versatile intermediate in pharmaceutical and agrochemical synthesis, particularly for the development of active ingredients and fine chemicals. Its carboxylic acid functionality allows for further derivatization, enabling the formation of amides, esters, and other derivatives. The compound exhibits good stability under standard conditions and is compatible with a range of reaction conditions. Its well-defined structure and reactivity profile make it valuable for research and industrial applications requiring precise molecular modifications.
2-methyl-1H-Pyrrole-3-carboxylic acid structure
37102-48-0 structure
Product Name:2-methyl-1H-Pyrrole-3-carboxylic acid
CAS No:37102-48-0
MF:C6H7NO2
MW:125.125281572342
MDL:MFCD01625949
CID:1025827
PubChem ID:255666
Update Time:2025-10-29

2-methyl-1H-Pyrrole-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 2-methyl-1H-Pyrrole-3-carboxylic acid
    • SB62050
    • NSC81358
    • SCHEMBL2549032
    • 2-methyl-1h-pyrrole-3-carboxylicacid
    • SY102543
    • EN300-98523
    • AKOS006350912
    • MFCD01625949
    • Z1203731440
    • AM803795
    • CHEMBL4636656
    • DTXSID20292288
    • 37102-48-0
    • 1H-Pyrrole-3-carboxylic acid, 2-methyl-
    • NSC-81358
    • YBJBJOLFTYIFKP-UHFFFAOYSA-N
    • BDBM50543166
    • CCG-40445
    • 2-Methyl-1H-pyrrole-3-carboxylic acid, AldrichCPR
    • DS-17009
    • 2-Methyl-3-pyrrolecarboxylic acid
    • W10234
    • CS-0038738
    • A853115
    • FT-0717613
    • ALBB-018078
    • DA-06366
    • 3-Pyrrolecarboxylic acid, 2-methyl-
    • MDL: MFCD01625949
    • Inchi: 1S/C6H7NO2/c1-4-5(6(8)9)2-3-7-4/h2-3,7H,1H3,(H,8,9)
    • InChI Key: YBJBJOLFTYIFKP-UHFFFAOYSA-N
    • SMILES: OC(C1C=CNC=1C)=O

Computed Properties

  • Exact Mass: 125.04771
  • Monoisotopic Mass: 125.047678
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 1
  • Complexity: 124
  • 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
  • Topological Polar Surface Area: 53.1
  • XLogP3: 0.6

Experimental Properties

  • Density: 1.295
  • Melting Point: 178-179 oC
  • Boiling Point: 322.4°C at 760 mmHg
  • Flash Point: 148.8°C
  • Refractive Index: 1.586
  • PSA: 53.09

2-methyl-1H-Pyrrole-3-carboxylic acid Security Information

  • Symbol: GHS07
  • Signal Word:Warning
  • Hazard Statement: H315-H319-H335
  • Warning Statement: P261-P305+P351+P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Hazard Category Code: 36/37/38
  • Safety Instruction: 26
  • Hazardous Material Identification: Xi
  • Storage Condition:Sealed in dry,Room Temperature(BD223595)

2-methyl-1H-Pyrrole-3-carboxylic acid Pricemore >>

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