Introduction：Basic information about CAS 874-79-3|Benzene, (propylthio)-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Benzene, (propylthio)- |
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| CAS Number | 874-79-3 | Molecular Weight | 152.25700 |
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| Density | 0.99g/cm3 | Boiling Point | 222.6ºC at 760 mmHg |
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| Molecular Formula | C9H12S | Melting Point | / |
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| MSDS | / | Flash Point | 87.2ºC |
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Names
| Name | propylsulfanylbenzene |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.99g/cm3 |
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| Boiling Point | 222.6ºC at 760 mmHg |
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| Molecular Formula | C9H12S |
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| Molecular Weight | 152.25700 |
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| Flash Point | 87.2ºC |
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| Exact Mass | 152.06600 |
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| PSA | 25.30000 |
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| LogP | 3.18870 |
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| Index of Refraction | 1.547 |
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| InChIKey | NWYDLOBJQIJDGH-UHFFFAOYSA-N |
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| SMILES | CCCSc1ccccc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- WQ5890000
- CHEMICAL NAME :
- Sulfide, phenyl propyl
- CAS REGISTRY NUMBER :
- 874-79-3
- BEILSTEIN REFERENCE NO. :
- 1857536
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C9-H12-S
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1800 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,993,1986
- TYPE OF TEST :
- LC50 - Lethal concentration, 50 percent kill
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 10 gm/m3/2H
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,993,1986
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Safety Information
| Risk Phrases | R20/22 |
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| Safety Phrases | S23-S36/37 |
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Synonyms
| SULFIDE,PHENYL PROPYL |
| propyl phenyl sulfide |
| phenyl n-propyl sulfide |
| phenyl 1-propyl sulfide |
| phenyl propyl sulfide |
| n-Propyl phenyl sulfide |
| phenyl propanyl sulfide |
