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Cas Database |
| Name |
3-Chlorothioanisole |
EINECS | -0 |
| CAS No. | 4867-37-2 | Density | 1.2 g/cm3 |
| PSA | 25.30000 | LogP | 3.06190 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C7H7ClS | Boiling Point | 217.9 °C at 760 mmHg |
| Molecular Weight | 158.652 | Flash Point | 87.6 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | 23-36/37-36-26 | Risk Codes | 22-36/37/38 |
| Molecular Structure |
|
Hazard Symbols |
 Xi
|
| Synonyms |
Sulfide,m-chlorophenyl methyl (6CI,7CI,8CI);3-(Methylthio)-1-chlorobenzene;3-Chlorophenyl methyl sulfide;Methyl 3-chlorophenylsulfide;Methyl m-chlorophenyl sulfide;NSC 133796;m-Chlorophenyl methylsulfide;m-Chlorothioanisole; |
Article Data | 15 |
3-Chlorothioanisole Chemical Properties
Molecular Structure of 3-Chlorothioanisole (CAS NO.4867-37-2):
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IUPAC Name: 1-chloro-3-methylsulfanylbenzene
Empirical Formula: C7H7ClS
Molecular Weight: 158.6485
BRN: 1931485
H bond acceptors: 0
H bond donors: 0
Freely Rotating Bonds: 1
Polar Surface Area: 25.3 Å2
Index of Refraction: 1.587
Molar Refractivity: 44.21 cm3
Molar Volume: 131.4 cm3
Surface Tension: 41.2 dyne/cm
Density: 1.2 g/cm3
Flash Point: 87.6 °C
Enthalpy of Vaporization: 43.58 kJ/mol
Boiling Point: 217.9 °C at 760 mmHg
Vapour Pressure: 0.19 mmHg at 25°C
Product Categories: Organic Building Blocks; Sulfides/Disulfides; Sulfur Compounds
InChI
InChI=1/C7H7ClS/c1-9-7-4-2-3-6(8)5-7/h2-5H,1H3
Smiles
c1c(SC)cccc1Cl
3-Chlorothioanisole Safety Profile
Hazard Codes: 
Xi
Risk Statements: 22-36/37/38
R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 23-36/37-36-26
S23:Do not breathe vapour.
S36/37:Wear suitable protective clothing and gloves.
S36:Wear suitable protective clothing.
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
RIDADR: 3334
Hazard Note: Irritant
HazardClass: Stench
3-Chlorothioanisole Specification
3-Chlorothioanisole , with CAS number of 4867-37-2, can be called 3-Cpms ; benzene, 1-chloro-3-(methylthio)- ; 1-Chloro-3-(methylsulfanyl)benzene .
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