Benzenepropanol, b-amino-4-hydroxy-, hydrochloride(1:1), (bR)- (40829-04-7)

The D-tyrosinol hydrochloride, with CAS registry number 40829-04-7, belongs to the following product categories: (1)Amino Acid Derivatives; (2)Amino Alcohols; (3)Peptide Synthesis. It has the systematic name of 4-[(2R)-2-amino-3-hydroxypropyl]phenol hydrochloride. This chemical should be stored at the temperature of 0-6°C.

Physical properties of D-tyrosinol hydrochloride: (1)ACD/LogP: 0.04; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 4; (9)#Freely Rotating Bonds: 6; (10)Polar Surface Area: 66.48 Å²; (11)Enthalpy of Vaporization: 68.49 kJ/mol; (12)Vapour Pressure: 4.46E-07 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The D-tyrosinol hydrochloride irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.Oc1ccc(C[C@@H](N)CO)cc1
(2)InChI: InChI=1/C9H13NO2.ClH/c10-8(6-11)5-7-1-3-9(12)4-2-7;/h1-4,8,11-12H,5-6,10H2;1H/t8-;/m1./s1
(3)InChIKey: PNGCRFWYSRUQTB-DDWIOCJRBL
(4)Std. InChI: InChI=1S/C9H13NO2.ClH/c10-8(6-11)5-7-1-3-9(12)4-2-7;/h1-4,8,11-12H,5-6,10H2;1H/t8-;/m1./s1
(5)Std. InChIKey: PNGCRFWYSRUQTB-DDWIOCJRSA-N