IUPAC Name: 2,4-Dichlorobenzenethiol
Canonical SMILES: C1=CC(=C(C=C1Cl)Cl)S
InChI: InChI=1S/C6H4Cl2S/c7-4-1-2-6(9)5(8)3-4/h1-3,9H
InChIKey: FGBVJFREPSJSNG-UHFFFAOYSA-N
Molecular Weight: 179.06696 [g/mol]
Molecular Formula: C6H4Cl2S
XLogP3: 3.5
EINECS: 214-346-7
Sensitive: Stench
Appearance: clear colorless liquid
Melting Point: 15 °C
Index of Refraction: 1.619
Molar Refractivity: 44.21 cm3
Molar Volume: 125.9 cm3
Surface Tension: 45.7 dyne/cm
Density: 1.421 g/cm3
Flash Point: 97.7 °C
Enthalpy of Vaporization: 46.41 kJ/mol
Boiling Point: 246.6 °C at 760 mmHg
Vapour Pressure: 0.0423 mmHg at 25 °C
Product Categories of Benzenethiol,2,4-dichloro- (CAS NO.1122-41-4): Phenol & Thiophenol&Mercaptan; Phenoles and thiophenoles; Organic Building Blocks; Sulfur Compounds; Thiols / Mercaptans
Hazard Codes: Xi
Risk Statements: 36/38
R36/38:Irritating to eyes and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
RIDADR: 2810
WGK Germany: 3
Hazard Note: Harmful/Stench
HazardClass: IRRITANT, STENCH
PackingGroup of Benzenethiol,2,4-dichloro- (CAS NO.1122-41-4): III
Benzenethiol,2,4-dichloro- (CAS NO.1122-41-4), its Synonyms are 2,4-Dichlorobenzenethiol ; 2,4-Dichlorothiophenol .
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