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Cas Database |
| Name |
Isobutaneboronic acid |
EINECS | 617-531-4 |
| CAS No. | 84110-40-7 | Density | 0.91 g/cm3 |
| PSA | 40.46000 | LogP | 0.11520 |
| Solubility | N/A | Melting Point |
108-111 °C |
| Formula | C4H11BO2 | Boiling Point | 180 °C at 760 mmHg |
| Molecular Weight | 101.941 | Flash Point | 62.7 °C |
| Transport Information | N/A | Appearance | white flake |
| Safety | 37/39-26 | Risk Codes | 36/37/38 |
| Molecular Structure |
|
Hazard Symbols |
 Xi
|
| Synonyms |
1-Propaneboronicacid, 2-methyl- (6CI,7CI);Boronic acid, (2-methylpropyl)- (9CI);2-Methylpropylboronic acid;Isobutyl boronic acid;Isobutylboric acid; |
Article Data | 14 |
Isobutaneboronic acid Synthetic route
- 84110-40-7
Dihydroxy-isobutyl-boran
| Conditions | Yield |
|---|---|
| With water; silica gel at 20℃; for 1h; Inert atmosphere; | 73% |
- 1116-39-8
triisobutylborane
- 84110-40-7
Dihydroxy-isobutyl-boran
| Conditions | Yield |
|---|---|
| With sodium hydroxide; air | |
| With H2O |
- 109511-11-7
isobutyl-bis-isobutylperoxy-borane
- 84110-40-7
Dihydroxy-isobutyl-boran
- 22980-59-2
isobutylboric acid dibutyl ester
- 84110-40-7
Dihydroxy-isobutyl-boran
| Conditions | Yield |
|---|---|
| With water |
- 112980-86-6
Me2(CH2)2NHOB-C4H9-iso
A
- 4404-98-2
4-amino-4-methylpentan-2-ol
B
- 26939-18-4
2,4,4,6-tetramethyl-5,6-dihydro-4H-1,3-oxazine
C
- 84110-40-7
Dihydroxy-isobutyl-boran
| Conditions | Yield |
|---|---|
| With sulfuric acid; acetonitrile In n-heptane at 0℃; for 5h; Title compound not separated from byproducts; |
- 112980-86-6
Me2(CH2)2NHOB-C4H9-iso
- 134-81-6
benzil
A
- 4404-98-2
4-amino-4-methylpentan-2-ol
B
- 26939-18-4
2,4,4,6-tetramethyl-5,6-dihydro-4H-1,3-oxazine
C
- 84110-40-7
Dihydroxy-isobutyl-boran
| Conditions | Yield |
|---|---|
| With sulfuric acid In n-heptane at 0℃; for 5h; Title compound not separated from byproducts; |
- 84110-40-7
Dihydroxy-isobutyl-boran
- 86595-33-7
sec-butyldiisopropoxyborane
- 84110-40-7
Dihydroxy-isobutyl-boran
| Conditions | Yield |
|---|---|
| With sulfuric acid |
| Conditions | Yield |
|---|---|
| In diethyl ether | |
| In diethyl ether |
Isobutaneboronic acid Chemical Properties
IUPAC Name: 2-methylpropylboronic acid
Empirical Formula: C4H11BO2
Molecular Weight: 101.9399
Structure of Boronic acid,B-(2-methylpropyl)- (CAS NO.84110-40-7):
Index of Refraction: 1.398
Molar Refractivity: 27.03 cm3
Molar Volume: 111.9 cm3
Polarizability: 10.71×10-24cm3
Surface Tension: 28.7 dyne/cm
Density: 0.91 g/cm3
Flash Point: 62.7 °C
Enthalpy of Vaporization: 48.46 kJ/mol
Melting Point: 108-111 °C(lit.)
Boiling Point: 180 °C at 760 mmHg
Vapour Pressure: 0.27 mmHg at 25°C
Product Categories: Boron, Nitrile, Thio,& TM-Cpds;Boronic acids;Organoborons;Alkyl;B (Classes of Boron Compounds);CHIRAL CHEMICALS
Canonical SMILES: B(CC(C)C)(O)O
InChI: InChI=1S/C4H11BO2/c1-4(2)3-5(6)7/h4,6-7H,3H2,1-2H3
InChIKey: ZAZPDOYUCVFPOI-UHFFFAOYSA-N
Synonyms of Boronic acid,B-(2-methylpropyl)- (CAS NO.84110-40-7): (2-Methylpropyl)boronic acid ; Isobutylboronic acid ; 2-Methylprop-1-ylboronic acid
Isobutaneboronic acid Safety Profile
Hazard Codes: 
Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 37/39-26
S37/39:Wear suitable gloves and eye/face protection.
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
WGK Germany: 3
Hazard Note: Irritant
HazardClass: IRRITANT
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