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123-09-1

123-09-1 structural image
Product Name: 4-CHLOROTHIOANISOLE
Formula: C7H7ClS
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colorless liquid with an unpleasant odor; [Alfa Aesar MSDS]
Vapor Pressure 0.11 [mmHg]
Chemical Classes Other Classes -> Sulfur Compounds

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H227:Flammable liquids
H302:Acute toxicity,oral
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P403+P235:Store in a well-ventilated place. Keep cool.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 158.65 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 1
Exact Mass 157.9956991 g/mol
Monoisotopic Mass 157.9956991 g/mol
Topological Polar Surface Area 25.3 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 77
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes