6-Benzothiazolesulfonamide, 2-amino- supplier

Name
2-Amino-1,3-benzothiazole-6-Sulfonamide
EINECS
CAS No. 18101-58-1
Article Data19
CAS DataBase
Density 1.667 g/cm³
Solubility
Melting Point
Formula C₇H₇N₃O₂S₂
Boiling Point 518.6 °C at 760 mmHg
Molecular Weight 229.283
Flash Point 267.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Aminobenzothiazole-6-sulfonicacid amide;
PSA 135.69000
LogP 2.88820

6-Benzothiazolesulfonamide, 2-amino- Specification

This chemical is called 6-Benzothiazolesulfonamide, 2-amino-, and its systematic name is 2-amino-1,3-benzothiazole-6-sulfonamide. With the molecular formula of C₇H₇N₃O₂S₂, its molecular weight is 229.28. The CAS registry number of this chemical is 18101-58-1.

Other characteristics of the 6-Benzothiazolesulfonamide, 2-amino- can be summarised as followings: (1)ACD/LogP: 0.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 23.68; (8)ACD/KOC (pH 7.4): 23.75; (9)#H bond acceptors: 5; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 90.13 Å²; (13)Index of Refraction: 1.755; (14)Molar Refractivity: 56.3 cm³; (15)Molar Volume: 137.4 cm³; (16)Polarizability: 22.32×10^-24cm³; (17)Surface Tension: 92.4 dyne/cm; (18)Density: 1.667 g/cm³; (19)Flash Point: 267.4 °C; (20)Enthalpy of Vaporization: 79.11 kJ/mol; (21)Boiling Point: 518.6 °C at 760 mmHg; (22)Vapour Pressure: 7.41E-11 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=S(=O)(c1ccc2nc(sc2c1)N)N
2.InChI: InChI=1/C7H7N3O2S2/c8-7-10-5-2-1-4(14(9,11)12)3-6(5)13-7/h1-3H,(H2,8,10)(H2,9,11,12)
3.InChIKey: CGJUKQLMOOVGOC-UHFFFAOYAO

Product Name

2-Amino-1,3-benzothiazole-6-Sulfonamide

6-Benzothiazolesulfonamide, 2-amino- Specification

Related Products

Hot Products