2,1,3-Benzothiadiazol-5-amine supplier

Name
2,1,3-Benzothiadiazol-5-amine
EINECS
CAS No. 874-37-3
Article Data11
CAS DataBase
Density 1.485g/cm³
Solubility
Melting Point 112-115°C
Formula C₆H₅N₃S
Boiling Point 303 °C at 760 mmHg
Molecular Weight 151.192
Flash Point 137.1 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 2,1,3-Benzothiadiazole,5-amino- (6CI,7CI,8CI);(2,1,3-Benzothiadiazol-5-yl)amine;2,1,3-Benzothiadiazol-2-SIV-5-amine;5-Amino-2,1,3-benzothiadiazole;5-Amino-benzo[1,2,5]thiadiazole;NSC 231627;
PSA 80.04000
LogP 1.85470

2,1,3-Benzothiadiazol-5-amine Specification

The 2,1,3-Benzothiadiazol-5-amine, with CAS registry number 874-37-3, has the systematic name of 2,1,3-benzothiadiazol-5-amine. Besides this, it is also called Benzo[1,2,5]thiadiazol-5-ylamine. And the chemical formula of this chemical is C₆H₅N₃S.

Physical properties of 2,1,3-Benzothiadiazol-5-amine: (1)ACD/LogP: 0.70; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 57.26 Å²; (7)Index of Refraction: 1.785; (8)Molar Refractivity: 42.89 cm³; (9)Molar Volume: 101.7 cm³; (10)Polarizability: 17×10^-24cm³; (11)Surface Tension: 84.3 dyne/cm; (12)Density: 1.485 g/cm³; (13)Flash Point: 137.1 °C; (14)Enthalpy of Vaporization: 54.33 kJ/mol; (15)Boiling Point: 303 °C at 760 mmHg; (16)Vapour Pressure: 0.000955 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The 2,1,3-Benzothiadiazol-5-amine irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: n1snc2cc(ccc12)N
(2)InChI: InChI=1/C6H5N3S/c7-4-1-2-5-6(3-4)9-10-8-5/h1-3H,7H2
(3)InChIKey: JRJPKRSKPOCUEV-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C6H5N3S/c7-4-1-2-5-6(3-4)9-10-8-5/h1-3H,7H2
(5)Std. InChIKey: JRJPKRSKPOCUEV-UHFFFAOYSA-N

Product Name

2,1,3-Benzothiadiazol-5-amine

2,1,3-Benzothiadiazol-5-amine Specification

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