Basic Information | Post buying leads | Suppliers |
Name |
1,2-Benzisothiazol-5-amine |
EINECS | N/A |
CAS No. | 53473-85-1 | Density | 1.383 g/cm3 |
PSA | 67.15000 | LogP | 2.45970 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H6N2S | Boiling Point | 232.5 °C at 760 mmHg |
Molecular Weight | 150.21 | Flash Point | 94.4 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1,2-Benzisothiazole,5-amino- (6CI,7CI);1,2-Benzisothiazole-5-amine;5-Amino-1,2-benzisothiazole; |
The 1,2-Benzisothiazol-5-amine, with the CAS registry number 53473-85-1, has the systematic name 1,2-benzothiazol-5-amine. Its molecular formula is C7H6N2S and its molecular weight is 150.21. Additionally, its product category is Amineprimary and its classification code is Mutation data.
Other characteristics of the 1,2-Benzisothiazol-5-amine can be summarised as followings: (1)ACD/LogP: 1.24; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 44.37 Å2; (7)Index of Refraction: 1.763; (8)Molar Refractivity: 44.8 cm3; (9)Molar Volume: 108.5 cm3; (10)Polarizability: 17.76×10-24cm3; (11)Surface Tension: 70.2 dyne/cm; (12)Density: 1.383 g/cm3; (13)Flash Point: 94.4 °C; (14)Enthalpy of Vaporization: 46.92 kJ/mol; (15)Boiling Point: 232.5 °C at 760 mmHg; (16)Vapour Pressure: 0.0588 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: n2sc1ccc(cc1c2)N
2.InChI: InChI=1/C7H6N2S/c8-6-1-2-7-5(3-6)4-9-10-7/h1-4H,8H2
3.InChIKey: LPUJHVNRGNTQPL-UHFFFAOYAW