5-Benzothiazolol,2-methyl- supplier

Name
2-METHYL-5-BENZOTHIAZOLOL
EINECS
CAS No. 68867-14-1
Article Data8
CAS DataBase
Density 1.365 g/cm³
Solubility
Melting Point 193-195 °C(lit.)
Formula C₈H₇NOS
Boiling Point 313.7 °C at 760 mmHg
Molecular Weight 165.216
Flash Point 143.5 °C
Transport Information
Appearance
Safety 26-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 2-Methyl-1,3-benzothiazol-5-ol;2-Methyl-5-hydroxybenzothiazole;2-Methylbenzothiazol-5-ol;5-Hydroxy-2-methylbenzothiazole;
PSA 61.36000
LogP 2.31030

5-Benzothiazolol,2-methyl- Specification

The 5-Benzothiazolol,2-methyl-, with the CAS registry number 68867-14-1, is also known as 5-Hydroxy-2-methylbenzothiazole. It belongs to the product category of Benzothiazole. This chemical's molecular formula is C₈H₇NOS and molecular weight is 165.21. What's more, its systematic name is 2-Methyl-1,3-benzothiazol-5-ol.

Physical properties of 5-Benzothiazolol,2-methyl- are: (1)ACD/LogP: 1.67; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 50.36 Å²; (7)Index of Refraction: 1.71; (8)Molar Refractivity: 47.27 cm³; (9)Molar Volume: 120.9 cm³; (10)Polarizability: 18.74×10^-24 cm³; (11)Surface Tension: 63.2 dyne/cm; (12)Density: 1.365 g/cm³; (13)Flash Point: 143.5 °C; (14)Enthalpy of Vaporization: 57.7 kJ/mol; (15)Boiling Point: 313.7 °C at 760 mmHg; (16)Vapour Pressure: 0.000264 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)SMILES: n1c2cc(O)ccc2sc1C
(2)InChI: InChI=1/C8H7NOS/c1-5-9-7-4-6(10)2-3-8(7)11-5/h2-4,10H,1H3
(3)InChIKey: LAKVUPMDDFICNR-UHFFFAOYAL

Product Name

2-METHYL-5-BENZOTHIAZOLOL

5-Benzothiazolol,2-methyl- Specification

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