Cas no 18711-59-6 (4-Methyl-1H-pyrrole-2-carboxylic acid)

4-Methyl-1H-pyrrole-2-carboxylic acid structure
18711-59-6 structure
Product Name:4-Methyl-1H-pyrrole-2-carboxylic acid
CAS No:18711-59-6
MF:C6H7NO2
MW:125.125281572342
MDL:MFCD03839931
CID:51135
PubChem ID:14643173
Update Time:2025-04-18

4-Methyl-1H-pyrrole-2-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 4-Methyl-1H-pyrrole-2-carboxylic acid
    • 4-METHYL PYRROLE-2-CARBOXYLIC ACID
    • C6H7NO2
    • 2-Carboxy-4-methyl-pyrrol
    • 4-Methyl-2-carboxy-pyrrol
    • 4-Methyl-pyrrol-2-carbonsaeure
    • 4-methylpyrrol-2-carboxylate
    • 1H-Pyrrole-2-carboxylic acid, 4-methyl-
    • REF DUPL: 4-Methyl pyrrole-2-carboxylic acid
    • 4-Methylpyrrole-2-carboxylic acid 97%
    • Z1201622537
    • AKOS006343010
    • TS-01639
    • 4-methyl-pyrrole-2-carboxylic acid
    • DTXSID30562520
    • CS-0139576
    • 18711-59-6
    • 4-Methylpyrrole-2-carboxylic acid
    • 4-Methylpyrrole-2-carboxylic acid, 97%
    • 4-Methyl-1H-pyrrole-2-carboxylicacid
    • SCHEMBL1337277
    • SB62139
    • AMY14426
    • AC-6349
    • EN300-102085
    • MFCD03839931
    • FT-0659125
    • YXYAHRAFINYJPL-UHFFFAOYSA-N
    • SY045725
    • 2-Pyrrolecarboxylic acid, 4-methyl-
    • DB-012208
    • MDL: MFCD03839931
    • Inchi: 1S/C6H7NO2/c1-4-2-5(6(8)9)7-3-4/h2-3,7H,1H3,(H,8,9)
    • InChI Key: YXYAHRAFINYJPL-UHFFFAOYSA-N
    • SMILES: OC(C1=CC(C)=CN1)=O

Computed Properties

  • Exact Mass: 125.04800
  • Monoisotopic Mass: 125.047678466g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • 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
  • XLogP3: 0.9
  • Topological Polar Surface Area: 53.1?2

Experimental Properties

  • Color/Form: White to Yellow Solid
  • Density: 1.295
  • Melting Point: 200-205?°C
  • Boiling Point: 326.3°Cat760mmHg
  • Flash Point: 151.1°C
  • Refractive Index: 1.587
  • PSA: 53.09000
  • LogP: 1.02130

4-Methyl-1H-pyrrole-2-carboxylic acid Security Information

4-Methyl-1H-pyrrole-2-carboxylic acid Customs Data

  • HS CODE:2933990090
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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4-Methyl-1H-pyrrole-2-carboxylic acid Production Method

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