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Name |
2,1-Benzisothiazol-3-amine |
EINECS | N/A |
CAS No. | 2400-12-6 | Density | 1.384 g/cm3 |
PSA | 67.15000 | LogP | 2.45970 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H6N2S | Boiling Point | 315.253 °C at 760 mmHg |
Molecular Weight | 150.204 | Flash Point | 144.46 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2,1-Benzisothiazole,3-amino- (7CI,8CI);3-Amino-2,1-benzisothiazole; |
Article Data | 3 |
The 2,1-Benzisothiazol-3-amine, with the CAS registry number 2400-12-6, is also known as CCRIS 8327. It belongs to the product category of Amineprimary. This chemical's molecular formula is C7H6N2S and molecular weight is 150.20094. Its IUPAC name is called 2,1-benzothiazol-3-amine.
Physical properties of 2,1-Benzisothiazol-3-amine: (1)ACD/LogP: 0.81; (2)#H bond acceptors: 2; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 1; (5)Index of Refraction: 1.763; (6)Molar Refractivity: 44.807 cm3; (7)Molar Volume: 108.533 cm3; (8)Surface Tension: 70.282 dyne/cm; (9)Density: 1.384 g/cm3; (10)Flash Point: 144.46 °C; (11)Enthalpy of Vaporization: 55.648 kJ/mol; (12)Boiling Point: 315.253 °C at 760 mmHg; (13)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC2=C(SN=C2C=C1)N
(2)InChI: InChI=1S/C7H6N2S/c8-7-5-3-1-2-4-6(5)9-10-7/h1-4H,8H2
(3)InChIKey: JSKJAICVFPRVHJ-UHFFFAOYSA-N