The Sodium bisulfate monohydrate, with the CAS registry number 10034-88-5 and EINECS registry number 231-665-7, has the systematic name of sodium hydrogen sulfate hydrate (1:1:1). It is a kind of white adhering crystals which is sensitive to moisture. And the molecular formula of this chemical is NaHSO₄^.H₂O.

The physical properties of Sodium bisulfate monohydrate are as followings: (1)ACD/LogP: -1.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -5.53; (4)ACD/LogD (pH 7.4): -5.53; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 0; (10)Polar Surface Area: 71.98 Å²; (11)Enthalpy of Vaporization: 62.94 kJ/mol; (12)Boiling Point: 330 °C at 760 mmHg; (13)Vapour Pressure: 3.35E-05 mmHg at 25°C.

Preparation of Sodium bisulfate monohydrate: Thenardite reacts with sulphuric acid, and after a series of Filtration, crystallization, separation, drying, you can get the Sodium hydrogen sulfate monohydrae.
Na₂SO₄+H₂SO₄→2NaHSO₄

Applications of Sodium bisulfate monohydrate: It is usually used as dyeing auxiliaries for acid dye in printing and dyeing industry, fluxing agent for mineral decomposition in metallurgy industry, and disinfectants & detergents in medical industry.

You should be cautious while dealing with this chemical. It may cause serious damage to eyes. Therefore, you had better take the following instructions: Avoid contact with skin, and in case of 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: [Na+].[O-]S(=O)(=O)O.O
(2)InChI: InChI=1/Na.H2O4S.H2O/c;1-5(2,3)4;/h;(H2,1,2,3,4);1H2/q+1;;/p-1
(3)InChIKey: JXHZRQHZVYDRGX-REWHXWOFAC

The toxicity data is as follows: