Cas no 1198605-53-6 (Methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-2-carboxylate)

Methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-2-carboxylate structure
1198605-53-6 structure
Product Name:Methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-2-carboxylate
CAS No:1198605-53-6
MF:C12H18BNO4
MW:251.086623668671
MDL:MFCD16995409
CID:2131487
PubChem ID:44557754
Update Time:2025-04-21

Methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • METHYL 4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRROLE-2-CARBOXYLATE
    • FHFIOJIHWCKHMQ-UHFFFAOYSA-N
    • PubChem24409
    • MB18089
    • 1H-Pyrrole-2-carboxylic acid, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester
    • methyl 4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-2-carboxylate
    • YXB60553
    • DTXSID70659322
    • 1198605-53-6
    • CS-15513
    • C13658
    • MFCD16995409
    • EN300-7355352
    • DA-17872
    • SCHEMBL9275348
    • CS-0040767
    • Methyl4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-2-carboxylate
    • Z2050071525
    • AKOS026672494
    • 2-Methoxycarbonyl-1H-pyrrole-4-boronic Acid pinacol ester
    • DTXCID90610071
    • 859-653-2
    • Methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-2-carboxylate
    • MDL: MFCD16995409
    • Inchi: 1S/C12H18BNO4/c1-11(2)12(3,4)18-13(17-11)8-6-9(14-7-8)10(15)16-5/h6-7,14H,1-5H3
    • InChI Key: FHFIOJIHWCKHMQ-UHFFFAOYSA-N
    • SMILES: O1B(C2=CNC(C(=O)OC)=C2)OC(C)(C)C1(C)C

Computed Properties

  • Exact Mass: 251.13300
  • Monoisotopic Mass: 251.1328882g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 329
  • 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: 60.6

Experimental Properties

  • PSA: 60.55000
  • LogP: 1.10050

Methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-2-carboxylate Pricemore >>

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Methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-2-carboxylate
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Methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-2-carboxylate
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$6033.0 2023-09-06
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Methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-2-carboxylate Production Method

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