1122-97-0
Product Name:
4-(METHYLTHIO)THIOPHENOL
Formula:
C7H8S2
Synonyms:
4-(Methylthio)benzenethiol;4-(Methylthio)phenyl mercaptan
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Kovats Retention Index | 1363 1367 |
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SAFETY INFORMATION
Signal word | Danger |
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Pictogram(s) |
Health Hazard GHS08 |
GHS Hazard Statements |
H319:Serious eye damage/eye irritation H334:Sensitisation, respiratory |
Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. P342+P311:IF experiencing respiratory symptoms: call a POISON CENTER or doctor/physician. |
COMPUTED DESCRIPTORS
Molecular Weight | 156.3 g/mol |
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XLogP3 | 2.6 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 1 |
Exact Mass | 156.00674260 g/mol |
Monoisotopic Mass | 156.00674260 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 9 |
Formal Charge | 0 |
Complexity | 75 |
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 |