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Cas Database |
| Name |
3-(Trifluoromethyl)thiophenol |
EINECS | N/A |
| CAS No. | 937-00-8 | Density | 1.314 g/cm3 |
| PSA | 38.80000 | LogP | 2.99410 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C7H5F3S | Boiling Point | 175.4 °C at 760 mmHg |
| Molecular Weight | 178.178 | Flash Point | 63 °C |
| Transport Information | N/A | Appearance | clear colorless liquid |
| Safety | S26; S36/37/39 | Risk Codes | R36/37/38 |
| Molecular Structure |
|
Hazard Symbols |
 Xi
|
| Synonyms |
m-Toluenethiol,a,a,a-trifluoro- (6CI,7CI,8CI);3-(Trifluoromethyl)benzenethiol;3-(Trifluoromethyl)thiophenol;NSC 88281;m-(Trifluoromethyl)thiophenol;m-Trifluoromethylbenzenethiol; |
Article Data | 10 |
3-(Trifluoromethyl)thiophenol Chemical Properties
Molecular Structure of Benzenethiol,3-(trifluoromethyl)- (CAS NO.937-00-8):
.png)
IUPAC Name: 3-(trifluoromethyl)benzenethiol
Empirical Formula: C7H5F3S
Molecular Weight: 178.1748
H bond acceptors: 0
H bond donors: 0
Freely Rotating Bonds: 1
Polar Surface Area: 25.3Å2
Index of Refraction: 1.493
Molar Refractivity: 39.4 cm3
Molar Volume: 135.5 cm3
Surface Tension: 28.4 dyne/cm
Density: 1.314 g/cm3
Flash Point: 63 °C
Enthalpy of Vaporization: 39.48 kJ/mol
Boiling Point: 175.4 °C at 760 mmHg
Vapour Pressure: 1.54 mmHg at 25°C
Sensitive: Stench
BRN: 1943114
InChI
InChI=1/C7H5F3S/c8-7(9,10)5-2-1-3-6(11)4-5/h1-4,11H
Smiles
C(c1cc(S)ccc1)(F)(F)F
Product Categories: Phenol&Thiophenol&Mercaptan
3-(Trifluoromethyl)thiophenol Safety Profile
Hazard Codes: 
Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36/37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
RIDADR: 3334
Hazard Note: Irritant/Stench
HazardClass: Irritant/Stench
3-(Trifluoromethyl)thiophenol Specification
Benzenethiol,3-(trifluoromethyl)- , with CAS number of 937-00-8, can be called 3-(trifluoromethyl)benzene-1-thiol ; 3-(Trifluoromethyl)benzenethiol ; 3-Trifluoromethylthiophenol ; m-Trifluoromethylthiophenol .
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