Cas no 516465-80-8 (1-o-tert-butyl 2-o-ethyl 4-bromopyrrole-1,2-dicarboxylate)

1-o-tert-butyl 2-o-ethyl 4-bromopyrrole-1,2-dicarboxylate structure
516465-80-8 structure
Product Name:1-o-tert-butyl 2-o-ethyl 4-bromopyrrole-1,2-dicarboxylate
CAS No:516465-80-8
MF:C12H16BrNO4
MW:318.163743019104
CID:1573460
PubChem ID:11220846
Update Time:2025-04-21

1-o-tert-butyl 2-o-ethyl 4-bromopyrrole-1,2-dicarboxylate Chemical and Physical Properties

Names and Identifiers

    • 1-O-tert-butyl 2-O-ethyl 4-bromopyrrole-1,2-dicarboxylate
    • 4-BROMO-PYRROLE-1,2-DICARBOXYLIC ACID 1-TERT-BUTYL ESTER 2-ETHYL ESTER
    • 1-tert-Butyl 2-ethyl 4-bromo-1H-pyrrole-1,2-dicarboxylate
    • Ethyl N-Boc-4-bromopyrrole-2-carboxylate
    • 516465-80-8
    • DB-305498
    • 1-(tert-Butyl) 2-ethyl 4-bromo-1H-pyrrole-1,2-dicarboxylate
    • 4-bromopyrrole-1,2-dicarboxylic acid 1-tert-butyl ester 2-ethyl ester
    • SCHEMBL3436434
    • DTXSID80459239
    • 1-o-tert-butyl 2-o-ethyl 4-bromopyrrole-1,2-dicarboxylate
    • Inchi: 1S/C12H16BrNO4/c1-5-17-10(15)9-6-8(13)7-14(9)11(16)18-12(2,3)4/h6-7H,5H2,1-4H3
    • InChI Key: ASOVJULXRZCTEI-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C(=O)OCC)N(C=1)C(=O)OC(C)(C)C

Computed Properties

  • Exact Mass: 317.02600
  • Monoisotopic Mass: 317.02627g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 5
  • Complexity: 327
  • 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: 3.2
  • Topological Polar Surface Area: 57.5?2

Experimental Properties

  • PSA: 57.53000
  • LogP: 3.21050

1-o-tert-butyl 2-o-ethyl 4-bromopyrrole-1,2-dicarboxylate 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%

1-o-tert-butyl 2-o-ethyl 4-bromopyrrole-1,2-dicarboxylate Pricemore >>

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1-o-tert-butyl 2-o-ethyl 4-bromopyrrole-1,2-dicarboxylate Production Method

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