Product Name

  • Name

    3,5-Dimethoxyphenylboronic acid

  • EINECS
  • CAS No. 192182-54-0
  • Article Data20
  • CAS DataBase
  • Density 1.19 g/cm3
  • Solubility
  • Melting Point 205-207 °C
  • Formula C8H11BO4
  • Boiling Point 371.6 °C at 760 mmHg
  • Molecular Weight 181.984
  • Flash Point 178.5 °C
  • Transport Information
  • Appearance
  • Safety 26-36/37/39
  • Risk Codes 36/37/38
  • Molecular Structure Molecular Structure of 192182-54-0 (3,5-Dimethoxyphenylboronic acid)
  • Hazard Symbols IrritantXi
  • Synonyms 3,5-Dimethoxybenzeneboronic acid;3,5-Dimethoxybenzene boronic acid;
  • PSA 58.92000
  • LogP -0.61640

3,5-Dimethoxyphenylboronic acid Specification

The CAS register number of 3,5-Dimethoxyphenylboronic acid is 192182-54-0. It also can be called as Boronic acid, B-(3,5-dimethoxyphenyl)- and the IUPAC name about this chemical is (3,5-dimethoxyphenyl)boronic acid. The molecular formula about this chemical is C8H11BO4 and the molecular weight is 181.98. It belongs to the following product categories, such as Blocks; BoronicAcids; Heterocyclic Compounds; Boronic Acid; B (Classes of Boron Compounds); Boronic Acids and so on. If you want to store this chemical, the storage temperature need keep cold.

Physical properties about 3,5-Dimethoxyphenylboronic acid are: (1)ACD/LogP: 1.30; (2)ACD/LogD (pH 5.5): 1.3; (3)ACD/LogD (pH 7.4): 1.11; (4)ACD/BCF (pH 5.5): 5.69; (5)ACD/BCF (pH 7.4): 3.73; (6)ACD/KOC (pH 5.5): 120.62; (7)ACD/KOC (pH 7.4): 79.08; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 36.92Å2; (12)Index of Refraction: 1.517; (13)Molar Refractivity: 46.01 cm3; (14)Molar Volume: 151.8 cm3; (15)Polarizability: 18.24x10-24cm3; (16)Surface Tension: 43 dyne/cm; (17)Boiling Point: 371.6 °C at 760 mmHg; (18)Vapour Pressure: 3.52E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1cc(cc(OC)c1)B(O)O)C
(2)InChI: InChI=1/C8H11BO4/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-5,10-11H,1-2H3
(3)InChIKey: XUIURRYWQBBCCK-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C8H11BO4/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-5,10-11H,1-2H3
(5)Std. InChIKey: XUIURRYWQBBCCK-UHFFFAOYSA-N

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