Introduction：Basic information about CAS 39565-00-9|2-ACETYL-5-NITROTHIOPHENE, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-ACETYL-5-NITROTHIOPHENE |
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| CAS Number | 39565-00-9 | Molecular Weight | 171.17400 |
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| Density | 1.399g/cm3 | Boiling Point | 268.9ºC at 760mmHg |
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| Molecular Formula | C6H5NO3S | Melting Point | 107-108ºC |
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| MSDS | / | Flash Point | 116.4ºC |
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Names
| Name | 1-(5-nitrothiophen-2-yl)ethanone |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.399g/cm3 |
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| Boiling Point | 268.9ºC at 760mmHg |
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| Melting Point | 107-108ºC |
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| Molecular Formula | C6H5NO3S |
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| Molecular Weight | 171.17400 |
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| Flash Point | 116.4ºC |
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| Exact Mass | 170.99900 |
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| PSA | 91.13000 |
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| LogP | 2.38210 |
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| Index of Refraction | 1.589 |
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| InChIKey | CMXUIQITENCDHH-UHFFFAOYSA-N |
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| SMILES | CC(=O)c1ccc([N+](=O)[O-])s1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- OB5040000
- CHEMICAL NAME :
- Ketone, methyl (5-nitro-2-thienyl)
- CAS REGISTRY NUMBER :
- 39565-00-9
- LAST UPDATED :
- 199410
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C6-H5-N-O2-S
- MOLECULAR WEIGHT :
- 155.18
- WISWESSER LINE NOTATION :
- T5SJ BV1 ENW
HEALTH HAZARD DATAACUTE TOXICITY DATAMUTATION DATA - TYPE OF TEST :
- Mutation in microorganisms
- TEST SYSTEM :
- Bacteria - Salmonella typhimurium
- DOSE/DURATION :
- 2500 ng/plate
- REFERENCE :
- CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 35,3611,1975
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Safety Information
| Risk Phrases | R20/21/22 |
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| Safety Phrases | S22-S36/37 |
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| RIDADR | UN2811 |
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| RTECS | OB5040000 |
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| Packaging Group | III |
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| Hazard Class | 6.1 |
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| HS Code | 2934999090 |
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Customs
| HS Code | 2934999090 |
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| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| 2-ACETYL-5-NITROTHIOPHENE |
| Thiophene,2-acetyl-5-nitro |
| Ethanone,1-(5-nitro-2-thienyl) |
| 1-(5-nitro-thiophen-2-yl)-ethanone |
| MFCD00041211 |
| 1-(5-Nitro-[2]thienyl)-aethanon |
| KETONE,METHYL (5-NITRO-2-THIENYL) |
| 5-acetyl-2-nitrothiophene |
| 1-(5-Nitro-2-thienyl)ethanone |
| 5-nitro-2-acetylthiophene |
