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Basic Information
CAS No.: 2400-12-6
Name: 2,1-Benzisothiazol-3-amine(9CI)
Article Data: 3
Molecular Structure:
Molecular Structure of 2400-12-6 (2,1-Benzisothiazol-3-amine(9CI))
Formula: C7H6N2S
Molecular Weight: 150.204
Synonyms: 2,1-Benzisothiazole,3-amino- (7CI,8CI);3-Amino-2,1-benzisothiazole;
Density: 1.384 g/cm3
Boiling Point: 315.253 °C at 760 mmHg
Flash Point: 144.46 °C
PSA: 67.15000
LogP: 2.45970
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Specification

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