Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
3-(Hydroxymethyl)phenylboronic acid |
EINECS | N/A |
CAS No. | 87199-15-3 | Density | 1.25 g/cm3 |
PSA | 60.69000 | LogP | -1.14130 |
Solubility | Soluble in water. | Melting Point |
95-99 °C(lit.) |
Formula | C7H9BO3 | Boiling Point | 380.5 °C at 760 mmHg |
Molecular Weight | 151.958 | Flash Point | 183.9 °C |
Transport Information | N/A | Appearance | off-white cryst |
Safety | 26-37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
Boronicacid, [3-(hydroxymethyl)phenyl]- (9CI);(m-Hydroxymethyl)phenylboronic acid;3-Hydroxymethylbenzeneboronic acid;3-(Hydroxymethyl)phenylboronic acid; |
Article Data | 4 |
The 3-(Hydroxymethyl)phenylboronic acid, with the CAS registry number 87199-15-3, is also known as Boronic acid, B-[3-(hydroxymethyl)phenyl]-. It belongs to the product categories of Blocks; Boronic Acids; Boric Acid; Boronic Acid series; Boronic Acid; Aryl; Organoborons; B (Classes of Boron Compounds); Boronic Acids; Boronic Acids; Boronic Acids and Derivatives. This chemical's molecular formula is C7H9BO3 and molecular weight is 151.96. Its IUPAC name is called [3-(hydroxymethyl)phenyl]boronic acid. The product should be sealed and stored at 4 °C. This chemical is off-white cryst.
Physical properties of 3-(Hydroxymethyl)phenylboronic acid: (1)ACD/LogP: 0.41; (2)ACD/LogD (pH 5.5): 0.41; (3)ACD/LogD (pH 7.4): 0.37; (4)ACD/BCF (pH 5.5): 1.2; (5)ACD/BCF (pH 7.4): 1.09; (6)ACD/KOC (pH 5.5): 39.55; (7)ACD/KOC (pH 7.4): 36.18; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 5; (11)Index of Refraction: 1.566; (12)Molar Refractivity: 39.44 cm3; (13)Molar Volume: 120.8 cm3; (14)Surface Tension: 53.6 dyne/cm; (15)Density: 1.25 g/cm3; (16)Flash Point: 183.9 °C; (17)Enthalpy of Vaporization: 66.31 kJ/mol; (18)Boiling Point: 380.5 °C at 760 mmHg; (19)Vapour Pressure: 1.82E-06 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: B(C1=CC(=CC=C1)CO)(O)O
(2)InChI: InChI=1S/C7H9BO3/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4,9-11H,5H2
(3)InChIKey: HGTDLKXUWVKLQX-UHFFFAOYSA-N