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BSA, 98-10-2 price min 99%, Benzenesulfonamide Benzenesulfonamide supplier
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1. Introduction of BSA
BSA (CAS NO.98-10-2) is one kind of white crystalline powder. The benzenesulfonamide is the IUPAC Name of this chemical. Besides, it belongs to the classification code which is Carbonic anhydrase inhibitors; Drug / Therapeutic Agent; Enzyme Inhibitors.
We have the min 99% BSA. The detailed information of this chemical is as follows:
BSA Name of product : Benzene sulfonamide ( BSA ) Molecular formula : C6H7NO2S Melting point : min 152°C Water : max 0.3% Colority (APHA) : max 50Pt/Co Chloride : max 100ppm Free Acid : max 0.2% Diphenyl sulfone : max 0.3%.
2. Basic information of BSA
1) Properties:
(1)XLogP3: 0.3; (2)H-Bond Donor: 1; (3)H-Bond Acceptor: 3; (4)Rotatable Bond Count: 1; (5)Exact Mass: 157.019749; (6)MonoIsotopic Mass: 157.019749; (7)Topological Polar Surface Area: 68.5; (8)Heavy Atom Count: 10; (9)Formal Charge: 0; (10)Complexity: 186; (11)Isotope Atom Count: 0; (12)Defined Atom Stereocenter Count: 0; (13)Undefined Atom Stereocenter Count: 0; (14)Defined Bond Stereocenter Count: 0; (15)Undefined Bond Stereocenter Count: 0; (16)Covalently-Bonded Unit Count: 1; (17)Feature 3D Acceptor Count: 2; (18)Feature 3D Donor Count: 1; (19)Feature 3D Ring Count: 1; (20)Effective Rotor Count: 1; (21)Conformer Sampling RMSD: 0.4.
2) Physical Properties
Physical Property | Value | Units | Temp (deg C) | Source |
---|---|---|---|---|
Melting Point | 151 | deg C | EXP | |
pKa Dissociation Constant | 10.1 | (none) | EXP | |
log P (octanol-water) | 0.31 | (none) | EXP | |
Water Solubility | 4300 | mg/L | 16 | EXP |
Vapor Pressure | 8.94E-04 | mm Hg | 25 | EST |
Henry's Law Constant | 4.22E-07 | atm-m3/mole | 25 | EST |
Atmospheric OH Rate Constant | 4.17E-13 | cm3/molecule-sec | 25 | EST |
3) Descriptors of Structure
Smiles: c1(ccccc1)S(N)(=O)=O
InChI: InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9)
InChIKey: KHBQMWCZKVMBLN-UHFFFAOYSA-N
Canonical SMILES: C1=CC=C(C=C1)S(=O)(=O)N
4) Production of BSA
This chemical can be obtained from the Benzenesulfonyl chloride.
5) Uses of BSA
BSA can be used in organic synthesis and pharmaceutical industry.
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