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CAS No.: | 18800-51-6 |
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Name: | 2,3-dimethylbenzenethiol |
Molecular Structure: | |
Formula: | C8H10S |
Molecular Weight: | 138.233 |
Synonyms: | 2,3-Xylenethiol(6CI,7CI,8CI); |
EINECS: | 242-586-2 |
Density: | 1.027 g/cm3 |
Melting Point: | -30°C (estimate) |
Boiling Point: | 217.07 °C at 760 mmHg |
Flash Point: | 84.645 °C |
PSA: | 38.80000 |
LogP: | 2.59210 |
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Molecular Structure of 2,3-dimethylbenzenethiol (CAS NO.18800-51-6):
IUPAC Name: 2,3-dimethylbenzenethiol
Empirical Formula: C8H10S
Molecular Weight: 138.23
H bond acceptors: 0
H bond donors: 0
Freely Rotating Bonds: 1
Polar Surface Area: 25.3 Å2
Index of Refraction: 1.568
Molar Refractivity: 44.07 cm3
Molar Volume: 134.5 cm3
Surface Tension: 36.6 dyne/cm
Density: 1.027 g/cm3
Flash Point: 84.6 °C
Enthalpy of Vaporization: 43.5 kJ/mol
Boiling Point: 217.1 °C at 760 mmHg
Vapour Pressure: 0.199 mmHg at 25°C
InChI
InChI=1/C8H10S/c1-6-4-3-5-8(9)7(6)2/h3-5,9H,1-2H3
Smiles
Sc1c(c(ccc1)C)C
EINECS: 242-586-2
Product Categories: Phenol&Thiophenol&Mercaptan
2,3-dimethylbenzenethiol , with CAS number of 18800-51-6, can be called benzenethiol, 2,3-dimethyl- ; Benzenethiol, dimethyl- ; 3-Methyl methylthiophenol .