Cas no 67974-08-7 (tert-Butyl 1-methyl-4-nitro-1H-pyrrole-2-carboxylate)

tert-Butyl 1-methyl-4-nitro-1H-pyrrole-2-carboxylate structure
67974-08-7 structure
Product Name:tert-Butyl 1-methyl-4-nitro-1H-pyrrole-2-carboxylate
CAS No:67974-08-7
MF:C10H14N2O4
MW:226.229162693024
CID:1081551
PubChem ID:2757296
Update Time:2025-04-20

tert-Butyl 1-methyl-4-nitro-1H-pyrrole-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • tert-Butyl 1-methyl-4-nitro-1H-pyrrole-2-carboxylate
    • tert-butyl 1-methyl-4-nitropyrrole-2-carboxylate
    • 1-methyl-4-nitro-1H-pyrrole-2-carboxylic acid tert-butyl ester
    • 1-methyl-4-nitro-pyrrole-2-carboxylic acid tert-butyl ester
    • tert-Butyl 1-methyl-4-nitro-1H-pyrrole-2
    • tert-butyl 4-nitro-1-methylpyrrole-2-carboxylate
    • 67974-08-7
    • FT-0752277
    • A922851
    • CS-0108285
    • AKOS013211021
    • AC-30394
    • SCHEMBL222848
    • DTXSID00373822
    • D76768
    • DB-073947
    • MDL： MFCD00631285
    • Inchi： 1S/C10H14N2O4/c1-10(2,3)16-9(13)8-5-7(12(14)15)6-11(8)4/h5-6H,1-4H3
    • InChI Key： LUCCDDXLASSKID-UHFFFAOYSA-N
    • SMILES： O(C(C1=CC(=CN1C)[N+](=O)[O-])=O)C(C)(C)C

Computed Properties

  • Exact Mass: 226.09500
  • Monoisotopic Mass: 226.09535693g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 292
  • 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: 1.7
  • Topological Polar Surface Area: 77?2

Experimental Properties

  • PSA: 77.05000
  • LogP: 2.41180

tert-Butyl 1-methyl-4-nitro-1H-pyrrole-2-carboxylate Security Information

  • Storage Condition：Sealed in dry,2-8°C

tert-Butyl 1-methyl-4-nitro-1H-pyrrole-2-carboxylate 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%

tert-Butyl 1-methyl-4-nitro-1H-pyrrole-2-carboxylate Pricemore >>

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