The Benzenethiol,2,4,6-trimethyl-, with CAS registry number 1541-10-2, has the systematic name of 2,4,6-trimethylbenzenethiol. Besides this, it is also called 2,4,6-trimethylbenzene-1-thiol. And the chemical formula of this chemical is C9H12S.
Physical properties of Benzenethiol,2,4,6-trimethyl-: (1)ACD/LogP: 3.90; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 0; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 25.3 Å2; (7)Index of Refraction: 1.561; (8)Molar Refractivity: 48.9 cm3; (9)Molar Volume: 150.8 cm3; (10)Polarizability: 19.38×10-24cm3; (11)Surface Tension: 35.6 dyne/cm; (12)Density: 1.009 g/cm3; (13)Flash Point: 91.3 °C; (14)Enthalpy of Vaporization: 44.94 kJ/mol; (15)Boiling Point: 231.8 °C at 760 mmHg; (16)Vapour Pressure: 0.0928 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The Benzenethiol,2,4,6-trimethyl- 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: Sc1c(cc(cc1C)C)C
(2)InChI: InChI=1/C9H12S/c1-6-4-7(2)9(10)8(3)5-6/h4-5,10H,1-3H3
(3)InChIKey: PKANQZUPJCMBAK-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C9H12S/c1-6-4-7(2)9(10)8(3)5-6/h4-5,10H,1-3H3
(5)Std. InChIKey: PKANQZUPJCMBAK-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