Introduction：Basic information about CAS 28122-76-1|Ethanethioic acid,S-(4-bromophenyl) ester, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Ethanethioic acid,S-(4-bromophenyl) ester |
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| CAS Number | 28122-76-1 | Molecular Weight | 231.11000 |
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| Density | 1.57g/cm3 | Boiling Point | 96ºC1 mm Hg(lit.) |
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| Molecular Formula | C8H7BrOS | Melting Point | 51-55ºC(lit.) |
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| MSDS | ChineseUSA | Flash Point | 128.7ºC |
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| Symbol |
GHS07 | Signal Word | Warning |
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Names
| Name | S-(4-bromophenyl) ethanethioate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.57g/cm3 |
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| Boiling Point | 96ºC1 mm Hg(lit.) |
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| Melting Point | 51-55ºC(lit.) |
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| Molecular Formula | C8H7BrOS |
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| Molecular Weight | 231.11000 |
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| Flash Point | 128.7ºC |
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| Exact Mass | 229.94000 |
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| PSA | 42.37000 |
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| LogP | 3.08770 |
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| Vapour Pressure | 0.00223mmHg at 25°C |
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| Index of Refraction | 1.622 |
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| InChIKey | ZILDXZXTWVSRDE-UHFFFAOYSA-N |
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| SMILES | CC(=O)Sc1ccc(Br)cc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- AJ5900000
- CHEMICAL NAME :
- Acetic acid, thio-, S-(p-bromophenyl) ester
- CAS REGISTRY NUMBER :
- 28122-76-1
- BEILSTEIN REFERENCE NO. :
- 1940540
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C8-H7-Br-O-S
- MOLECULAR WEIGHT :
- 231.12
- WISWESSER LINE NOTATION :
- ER DSV1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 3 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- YKKZAJ Yakugaku Zasshi. Journal of Pharmacy. (Nippon Yakugakkai, 2-12-15 Shibuya, Shibuya-ku, Tokyo 150, Japan) No.1- 1881- Volume(issue)/page/year: 89,1179,1969
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Safety Information
| Symbol |
GHS07 |
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| Signal Word | Warning |
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| Hazard Statements | H317 |
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| Precautionary Statements | P280 |
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| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Faceshields;Gloves |
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| Hazard Codes | Xn: Harmful; |
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| Risk Phrases | 22-43 |
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| Safety Phrases | 36 |
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| RIDADR | UN 3335 |
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| RTECS | AJ5900000 |
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| HS Code | 2930909090 |
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Customs
| HS Code | 2930909090 |
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| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Synonyms
| 4-substituted phenylthiol acetate |
| acetyl 4-bromo-thiophenolate |
| 4-BrC6H4SAc |
| MFCD05865194 |
| thioacetic acid S-4-bromophenyl ester |
| WLN: ER DSV1 |
| 1-(acetylthio)-4-bromobenzene |
| Ethanethioic acid,S-(4-bromophenyl) ester |
| S-4-bromophenyl ethanethioate |
| S-(p-Bromophenyl) thioacetate |
| ACETIC ACID,THIO-,S-(p-BROMOPHENYL) ESTER |
