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CAS No.: | 80223-99-0 |
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Name: | Tamsulosin hydrochloride |
Molecular Structure: | |
Formula: | C20H28N2O5S.HCl |
Molecular Weight: | 444.98 |
Synonyms: | Benzenesulfonamide,5-[2-[[2-(2-ethoxyphenoxy)ethyl]amino]propyl]-2-methoxy-, monohydrochloride(9CI);LY 253352;YM 12617;dl-Tamsulosin hydrochloride; |
Melting Point: | 228-230℃ |
Boiling Point: | 595.5 °C at 760 mmHg |
Flash Point: | 313.9 °C |
PSA: | 108.26000 |
LogP: | 5.31490 |
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The CAS register number of Benzenesulfonamide,5-[2-[[2-(2-ethoxyphenoxy)ethyl]amino]propyl]-2-methoxy-, hydrochloride (1:1) is 80223-99-0. It also can be called as Tamsulosin hydrochloride and the systematic name about this chemical is 5-[(2R)-2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl]-2-methoxybenzenesulfonamide hydrochloride. The molecular formula about this chemical is C20H28N2O5S.HCl and molecular weight is 444.97.
Physical properties about Benzenesulfonamide,5-[2-[[2-(2-ethoxyphenoxy)ethyl]amino]propyl]-2-methoxy-, hydrochloride (1:1) are: (1)ACD/LogP: 2.24; (2)ACD/LogD (pH 7.4): 0.79; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1.06; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 14.13; (7)#H bond acceptors: 7; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 11; (10)Polar Surface Area: 76.69Å2; (11)Flash Point: 313.9 °C; (12)Enthalpy of Vaporization: 88.74 kJ/mol; (13)Boiling Point: 595.5 °C at 760 mmHg; (14)Vapour Pressure: 3.79E-14 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.O=S(=O)(N)c1c(OC)ccc(c1)C[C@H](NCCOc2ccccc2OCC)C
(2)InChI: InChI=1/C20H28N2O5S.ClH/c1-4-26-17-7-5-6-8-18(17)27-12-11-22-15(2)13-16-9-10-19(25-3)20(14-16)28(21,23)24;/h5-10,14-15,22H,4,11-13H2,1-3H3,(H2,21,23,24);1H/t15-;/m1./s1
(3)InChIKey: ZZIZZTHXZRDOFM-XFULWGLBBU
(4)Std. InChI: InChI=1S/C20H28N2O5S.ClH/c1-4-26-17-7-5-6-8-18(17)27-12-11-22-15(2)13-16-9-10-19(25-3)20(14-16)28(21,23)24;/h5-10,14-15,22H,4,11-13H2,1-3H3,(H2,21,23,24);1H/t15-;/m1./s1
(5)Std. InChIKey: ZZIZZTHXZRDOFM-XFULWGLBSA-N