Cas no 1196-90-3 (Methyl 4-bromo-1-methyl-1H-pyrrole-2-carboxylate)

Methyl 4-bromo-1-methyl-1H-pyrrole-2-carboxylate structure
1196-90-3 structure
Product Name:Methyl 4-bromo-1-methyl-1H-pyrrole-2-carboxylate
CAS No:1196-90-3
MF:C7H8BrNO2
MW:218.0479
MDL:MFCD08275077
CID:117487
PubChem ID:11424498
Update Time:2024-11-03

Methyl 4-bromo-1-methyl-1H-pyrrole-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 4-bromo-1-methyl-1H-pyrrole-2-carboxylate
    • Methyl 4-Bromo-1-methylpyrrole-2-carboxylate
    • 1H-Pyrrole-2-carboxylicacid, 4-bromo-1-methyl-, methyl ester
    • 4-Bromo-1-methyl-1H-pyrrole-2-carboxylic acid methyl ester
    • 4-Brom-1-methyl-pyrrol-2-carbonsaeure-methylester
    • ACMC-1BVSN
    • AGN-PC-008U76
    • CTK4B1444
    • Methyl 4-bromo-N-methyl-2-pyrrolecarboxylate
    • 1H-Pyrrole-2-carboxylic acid, 4-bromo-1-methyl-, methyl ester
    • methylbromomethylpyrrolecarboxylate
    • XYZFZMSLKMPMGW-UHFFFAOYSA-N
    • SBB053896
    • AB44694
    • TRA0024578
    • RP12597
    • SY033375
    • AM803026
    • X3424
    • J-522317
    • DTXSID70465440
    • CS-0037227
    • DB-061605
    • Methyl 4-bromo-1-methyl-1H-pyrrole-2-carboxylate, AldrichCPR
    • 1196-90-3
    • Methyl 4-bromo-1-methyl-pyrrole-2-carboxylate
    • 10Z-0817
    • EN300-1912670
    • BAA19690
    • AKOS005069365
    • methyl-4-bromo-1-methyl-1H-pyrrole-2-carboxylate
    • Z210275194
    • SCHEMBL1254373
    • MFCD08275077
    • MDL： MFCD08275077
    • Inchi： 1S/C7H8BrNO2/c1-9-4-5(8)3-6(9)7(10)11-2/h3-4H,1-2H3
    • InChI Key： XYZFZMSLKMPMGW-UHFFFAOYSA-N
    • SMILES： BrC1C([H])=C(C(=O)OC([H])([H])[H])N(C([H])([H])[H])C=1[H]

Computed Properties

  • Exact Mass: 216.97400
  • Monoisotopic Mass: 216.97384g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 163
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 1.5
  • Topological Polar Surface Area: 31.2

Experimental Properties

  • Density: 1.53±0.1 g/cm3 (20 oC 760 Torr),
  • Melting Point: 61-64?°C
  • Boiling Point: 263.1±20.0 oC (760 Torr),
  • Flash Point: 112.9±21.8 oC,
  • Solubility: Slightly soluble (1.8 g/l) (25 o C),
  • PSA: 31.23000
  • LogP: 1.57420

Methyl 4-bromo-1-methyl-1H-pyrrole-2-carboxylate Security Information

  • Symbol: GHS07
  • Signal Word：Warning
  • Hazard Statement： H302
  • Warning Statement： P261-P305+P351+P338
  • Hazardous Material transportation number：NONH for all modes of transport
  • Hazard Category Code： 22
  • Hazardous Material Identification： Xi
  • HazardClass：IRRITANT
  • Storage Condition：2-8°C

Methyl 4-bromo-1-methyl-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%

Methyl 4-bromo-1-methyl-1H-pyrrole-2-carboxylate Pricemore >>

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