-
Name
6-Benzothiazolol(7CI,8CI,9CI)
- EINECS
- CAS No. 13599-84-3
- Article Data18
- CAS DataBase
- Density 1.444 g/cm3
- Solubility
- Melting Point 185.0 to 189.0 °C
- Formula C7H5NOS
- Boiling Point 311.6 °C at 760 mmHg
- Molecular Weight 151.189
- Flash Point 142.3 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 6-Hydroxybenzothiazole;
- PSA 61.36000
- LogP 2.00190
6-Benzothiazolol Specification
The 6-Benzothiazolol is an organic compound with the formula C7H5NOS. The IUPAC name of this chemical is 1,3-benzothiazol-6-ol. With the CAS registry number 13599-84-3, it is also named as 6-Hydroxybenzothiazole. The product's category is Benzothiazole.
Physical properties about 6-Benzothiazolol are: (1)ACD/LogP: 1.27; (2)#H bond acceptors: 2; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 1; (5)Polar Surface Area: 50.36 Å2; (6)Index of Refraction: 1.745; (7)Molar Refractivity: 42.45 cm3; (8)Molar Volume: 104.6 cm3; (9)Polarizability: 16.82×10-24cm3; (10)Surface Tension: 70.5 dyne/cm; (11)Density: 1.444 g/cm3; (12)Flash Point: 142.3 °C; (13)Enthalpy of Vaporization: 57.46 kJ/mol; (14)Boiling Point: 311.6 °C at 760 mmHg; (15)Vapour Pressure: 0.000304 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: n1c2ccc(O)cc2sc1
(2)InChI: InChI=1/C7H5NOS/c9-5-1-2-6-7(3-5)10-4-8-6/h1-4,9H
(3)InChIKey: ORIIXCOYEOIFSN-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C7H5NOS/c9-5-1-2-6-7(3-5)10-4-8-6/h1-4,9H
(5)Std. InChIKey: ORIIXCOYEOIFSN-UHFFFAOYSA-N
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View