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Cas Database |
| Name |
Trihydroxy boroxine |
EINECS | N/A |
| CAS No. | 13460-51-0 | Density | 1.48 g/cm3 |
| PSA | 88.38000 | LogP | -3.01860 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | H3B3O6 | Boiling Point | N/A |
| Molecular Weight | 131.453 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Metaboricacid (H3B3O6) (6CI);Boroxin, trihydroxy-;Trihydroxyboroxin; |
Article Data | 23 |
Trihydroxy boroxine Synthetic route
| Conditions | Yield |
|---|---|
| In neat (no solvent) reaction in steam at 1061 K;; | |
| In neat (no solvent) Kinetics; | |
| In neat (no solvent) Kinetics; | |
| In neat (no solvent) reaction in steam at 1061 K;; |
- 67-56-1
methanol
- 121-43-7
Trimethyl borate
- 11113-50-1
boric acid
A
- 13460-51-0
metaboric acid
B
- 102-24-9
cyclotriboric acid trimethyl ester
| Conditions | Yield |
|---|---|
| In methanol byproducts: H2O; at 100°C, filtration of metaboric acid;; |
- 11113-50-1
boric acid
- 13460-51-0
metaboric acid
| Conditions | Yield |
|---|---|
| In toluene azeotropic dehydration with toluene;; | |
| In toluene byproducts: H2O; dehydration in boiling toluene by azeotropic distn.;; | |
| In neat (no solvent) 95-100°C, 24h;; |
| Conditions | Yield |
|---|---|
| In neat (no solvent) heating to temperatures higher than 100°C;; | |
| In neat (no solvent) heating to temperatures higher than 100°C;; |
| Conditions | Yield |
|---|---|
| In neat (no solvent) byproducts: C4H9Br; at 20°C;; | |
| In neat (no solvent) byproducts: C4H9Br; at 20°C;; | 0% |
| In neat (no solvent) byproducts: C4H9Br; at 20°C;; | 0% |
| In neat (no solvent) byproducts: C4H9Br; at 20°C;; |
| Conditions | Yield |
|---|---|
| In water heating mixt. of boron oxide and water overnight to melt; different molar ratios of compds. were used; detected by Raman spectroscopy; |
| Conditions | Yield |
|---|---|
| In neat (no solvent) heating to 1900 to 2000°C in vacuum at 0.41 kbar;; |
- 13460-51-0
metaboric acid
- 13460-50-9
metaboric acid
| Conditions | Yield |
|---|---|
| In gaseous matrix Irradiation (UV/VIS); pulsed laser evapn. into an Ar stream condensed at 12 K; detd. by IR; |
Trihydroxy boroxine Specification
The Trihydroxy boroxine, also known as CID139461, is an organic compound with the formula B3H3O6. With the CAS registry number 13460-51-0, its IUPAC name is 2,4,6-trihydroxy-1,3,5,2,4,6-trioxatriborinane.
Physical properties of Trihydroxy boroxine: (1)#H bond acceptors: 6; (2)#H bond donors: 3; (3)#Freely Rotating Bonds: 3; (4)Index of Refraction: 1.374; (5)Molar Refractivity: 20.23 cm3; (6)Molar Volume: 88.4 cm3; (7)Surface Tension: 34.6 dyne/cm; (8)Density: 1.48 g/cm3.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: B1(OB(OB(O1)O)O)O
(2)InChI: InChI=1S/B3H3O6/c4-1-7-2(5)9-3(6)8-1/h4-6H
(3)InChIKey: AIUDKCYIGXXGIL-UHFFFAOYSA-N
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