Cas no 1184259-08-2 (3-Formyl-4-ntrophenylboronic Acid Pinacol Ester)

3-Formyl-4-ntrophenylboronic Acid Pinacol Ester structure
1184259-08-2 structure
Product Name:3-Formyl-4-ntrophenylboronic Acid Pinacol Ester
CAS No:1184259-08-2
MF:C13H16BNO5
MW:277.080843925476
CID:2431888
Update Time:2025-04-21

3-Formyl-4-ntrophenylboronic Acid Pinacol Ester Chemical and Physical Properties

Names and Identifiers

    • 3-Formyl-4-Nitrophenylboronic acid, pinacol ester
    • 3-Formyl-4-ntrophenylboronic Acid Pinacol Ester
    • Inchi: 1S/C13H16BNO5/c1-12(2)13(3,4)20-14(19-12)10-5-6-11(15(17)18)9(7-10)8-16/h5-8H,1-4H3
    • InChI Key: PQSNQQFRGFGLIV-UHFFFAOYSA-N
    • SMILES: O1B(C2C=CC(=C(C=O)C=2)[N+](=O)[O-])OC(C)(C)C1(C)C

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 3

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