Boronic acid,B-[4-(aminomethyl)phenyl]-, hydrochloride (1:1) (75705-21-4)

The 4-Aminomethylphenylboronicacid hydrochloride , with appearance of pale yellow powder, belongs to categories of Amines; blocks; BoronicAcids; Boronic acids; Amino; Aryl; Organoborons. Its cas registry number is 75705-21-4. Its IUPAC name and systematic name are the same which is called [4-(aminomethyl)phenyl]boronic acid hydrochloride .

Physical properties of 4-Aminomethylphenylboronicacid hydrochloride are: (1) ACD/LogP: 0.46 ; (2) # of Rule of 5 Violations: 0 ; (3) ACD/LogD (pH 5.5): -2.52 ; (4) ACD/LogD (pH 7.4): -1.26 ; (5) ACD/BCF (pH 5.5): 1 ; (6) ACD/BCF (pH 7.4): 1 ; (7) ACD/KOC (pH 5.5): 1 ; (8) ACD/KOC (pH 7.4): 1 ; (9) #H bond acceptors: 3 ; (10) #H bond donors: 4 ; (11) #Freely Rotating Bonds: 5 ; (12) Flash Point: 158.1 °C ; (13) Enthalpy of Vaporization: 61.33 kJ/mol ; (14) Boiling Point: 337.7 °C at 760 mmHg ; (15) Vapour Pressure: 4.02E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. You need wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. After use it, make sure store it at the temperature of 0-6°C.

You can still convert the following datas into molecular structure:
(1) SMILES:Cl.OB(O)c1ccc(cc1)CN;
(2) InChI:InChI=1/C7H10BNO2.ClH/c9-5-6-1-3-7(4-2-6)8(10)11;/h1-4,10-11H,5,9H2;1H;
(3) InChIKey:HUZNRXFJHYNUMV-UHFFFAOYAZ