Thieno[3,2-c]pyridine-5(4H)-carboxylicacid, 2-bromo-6,7-dihydro-, 1,1-dimethylethyl ester (949922-62-7)

tert-Butyl 2-bromo-6,7-dihydrothieno[3,2-c]pyridine-5(4H)-carboxylate , with the molecular formula C12H16BrNO2S, has the CAS register number 949922-62-7. And it also has other names like Thieno[3,2-c]pyridine-5(4H)-carboxylic acid, 2-bromo-6,7-dihydro-, 1,1-dimethylethyl ester .

Properties of this kind of chemical are as below: (1)ACD/LogP:  3.47 ; (2)ACD/LogD (pH 5.5):  3.47  ; (3)ACD/LogD (pH 7.4):  3.47  ; (4)ACD/BCF (pH 5.5):  256.83 ; (5) ACD/BCF (pH 7.4):  256.83  ; (6)ACD/KOC (pH 5.5):  1846.84  ; (7)ACD/KOC (pH 7.4):  1846.84  ; (8)#H bond acceptors:  3  ; (9)#Freely Rotating Bonds:  2  ; (10)Polar Surface Area:  57.78; (11)Index of Refraction:  1.576 ; (12) Molar Refractivity:  72.88 cm³  ; (13)Molar Volume:  220.1 cm³ ; (14)Polarizability:  28.89 ×10-24cm³  ; (15)Surface Tension:  47.1 dyne/cm; (16)Density:  1.445 g/cm³  ; (17)Flash Point:  185.3 °C ; (18)Enthalpy of Vaporization:  63.13 kJ/mol  ; (19)Boiling Point:  382.8 °C at 760 mmHg ; (20)Vapour Pressure:  4.59E-06 mmHg at 25°C .

This kind of chemical belongs to the category of chiral chemicals and is usually applied in the application of the intermediate in organic synetheses. Besides, it is also used as the chemical reagent in the laborary. This kind of chemical has many suppliers around the world, such as Ark Pharm.,Inc. , Wuhan KAIWEITE technology company and so on.

In addition, you could find the molecular by converting the following data information:
SMILES:
CC(C)(C)OC(=O)N1Cc2cc(Br)sc2CC1
InChI:
InChI=1/C12H16BrNO2S/c1-12(2,3)16-11(15)14-5-4-9-8(7-14)6-10(13)17-9/h6H,4-5,7H2,1-3H3