(+)-(6R)-2,6-Diamino-4,5,6,7-tetrahydrobenzothiazole supplier

Name
(+)-(6R)-2,6-Diamino-4,5,6,7-tetrahydrobenzothiazole
EINECS 690-698-9
CAS No. 106092-11-9
Article Data2
CAS DataBase
Density 1.313 g/cm³
Solubility
Melting Point 228-230 °C
Formula C₇H₁₁N₃S
Boiling Point 359 °C at 760 mmHg
Molecular Weight 169.25
Flash Point 170.9 °C
Transport Information
Appearance off-white solid
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,6-Benzothiazolediamine,4,5,6,7-tetrahydro-, (R)-;(R)-2,6-Diamino-4,5,6,7-tetrahydrobenzothiazole;(R)-4,5,6,7-Tetrahydrobenzothiazole-2,6-diamine;MolPort-002-501-553;AC-20378;R-(+)-2,6-Diamino-4,5,6,7- tetrahydrobenzothiazole;
PSA 93.17000
LogP 1.82280

(+)-(6R)-2,6-Diamino-4,5,6,7-tetrahydrobenzothiazole Specification

The 2,6-Benzothiazolediamine,4,5,6,7-tetrahydro-, (6R)- with CAS registry number of 106092-11-9 is also known as (R)-2,6-Diamino-4,5,6,7-tetrahydrobenzothiazole. The IUPAC name is (6R)-4,5,6,7-Tetrahydro-1,3-benzothiazole-2,6-diamine. It belongs to product categories of Intermidiate of Pramipexole; All Inhibitors; Inhibitors; Intermediates; Intermediates & Fine Chemicals; Pharmaceuticals. In addition, the formula is C₇H₁₁N₃S and the molecular weight is 169.25.

Physical properties about 2,6-Benzothiazolediamine,4,5,6,7-tetrahydro-, (6R)- are: (1)ACD/LogP: 0.26; (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: 1; (10)Polar Surface Area: 47.61Å²; (11)Index of Refraction: 1.655; (12)Molar Refractivity: 47.3 cm³; (13)Molar Volume: 128.8 cm³; (14)Polarizability: 18.75×10^-24cm³; (15)Surface Tension: 65.5 dyne/cm; (16)Density: 1.313 g/cm³; (17)Flash Point: 170.9 °C; (18)Enthalpy of Vaporization: 60.46 kJ/mol; (19)Boiling Point: 359 °C at 760 mmHg; (20)Vapour Pressure: 2.45E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: C1CC(Cc2c1nc(s2)N)N
2. InChI: InChI=1/C7H11N3S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h4H,1-3,8H2,(H2,9,10)/t4-/m1/s1
3. InChIKey: DRRYZHHKWSHHFT-SCSAIBSYBJ
4. Std. InChI: InChI=1S/C7H11N3S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h4H,1-3,8H2,(H2,9,10)/t4-/m1/s1
5. Std. InChIKey: DRRYZHHKWSHHFT-SCSAIBSYSA-N

Product Name

(+)-(6R)-2,6-Diamino-4,5,6,7-tetrahydrobenzothiazole

(+)-(6R)-2,6-Diamino-4,5,6,7-tetrahydrobenzothiazole Specification

Related Products

Hot Products