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CAS No.: | 146631-00-7 |
---|---|
Name: | 4-Benzyloxybenzeneboronic acid |
Article Data: | 20 |
Molecular Structure: | |
Formula: | C13H13BO3 |
Molecular Weight: | 228.055 |
Synonyms: | 4-(benzyloxy)phenylboronic acid;4-Benzyloxyphenyboronic acid; |
EINECS: | -0 |
Density: | 1.2 g/cm3 |
Melting Point: | 198-200 °C |
Boiling Point: | 418.9 °C at 760 mmHg |
Flash Point: | 207.2 °C |
Appearance: | white crystalline powder |
Hazard Symbols: | XiC |
Risk Codes: | 36/37/38 |
Safety: | 36/37/39-26 |
PSA: | 49.69000 |
LogP: | 0.94540 |
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Systematic Name: [4-(Benzyloxy)phenyl]boronic acid
CAS NO: 146631-00-7
Molecular Formula: C13H13BO3
Molecular Weight: 228.05
Molecular Structure:
H bond acceptors: 3
H bond donors: 2
Freely Rotating Bonds: 6
Polar Surface Area: 27.69 Å2
Index of Refraction: 1.593
Molar Refractivity: 64.36 cm3
Molar Volume: 189.7 cm3
Surface Tension: 49.8 dyne/cm
Density: 1.2 g/cm3
Flash Point: 207.2 °C
Enthalpy of Vaporization: 70.91 kJ/mol
Boiling Point: 418.9 °C at 760 mmHg
Vapour Pressure: 9.1E-08 mmHg at 25°C
Melting point: 198-200 °C
Appearance: white crystalline powder
Product Categories of 4-Benzyloxyphenylboronic acid (CAS NO.146631-00-7): blocks;BoronicAcids;Boronic acids;Heterocyclic Compounds;Aryl;Boronic acid;Organoborons;B (Classes of Boron Compounds);Boronic Acids;Boronic Acids and Derivatives
SMILES: O(c1ccc(cc1)B(O)O)Cc2ccccc2
InChI: InChI=1/C13H13BO3/c15-14(16)12-6-8-13(9-7-12)17-10-11-4-2-1-3-5-11/h1-9,15-16H,10H2
InChIKey: DMJHEIDWSIAXCS-UHFFFAOYAM
Std. InChI: InChI=1S/C13H13BO3/c15-14(16)12-6-8-13(9-7-12)17-10-11-4-2-1-3-5-11/h1-9,15-16H,10H2
Std. InChIKey: DMJHEIDWSIAXCS-UHFFFAOYSA-N
Safety Information of 4-Benzyloxyphenylboronic acid (CAS NO.146631-00-7):
Hazard Codes: XiC
Risk Statements: 36/37/38
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 36/37/39-26
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.
Hazard Note: Corrosive