Introduction:Basic information about CAS 137-03-1|2-Heptylcyclopentanone, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-Heptylcyclopentanone |
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| CAS Number | 137-03-1 | Molecular Weight | 182.303 |
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| Density | 0.9±0.1 g/cm3 | Boiling Point | 251.5±8.0 °C at 760 mmHg |
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| Molecular Formula | C12H22O | Melting Point | / |
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| MSDS | / | Flash Point | 98.6±10.7 °C |
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Names
| Name | 2-Heptylcyclopentanone |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.9±0.1 g/cm3 |
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| Boiling Point | 251.5±8.0 °C at 760 mmHg |
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| Molecular Formula | C12H22O |
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| Molecular Weight | 182.303 |
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| Flash Point | 98.6±10.7 °C |
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| Exact Mass | 182.167068 |
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| PSA | 17.07000 |
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| LogP | 3.88 |
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| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
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| Index of Refraction | 1.455 |
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| InChIKey | PJXHBTZLHITWFX-UHFFFAOYSA-N |
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| SMILES | CCCCCCCC1CCCC1=O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- GY4950000
- CHEMICAL NAME :
- Cyclopentanone, 2-heptyl-
- CAS REGISTRY NUMBER :
- 137-03-1
- BEILSTEIN REFERENCE NO. :
- 2043445
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 4
- MOLECULAR FORMULA :
- C12-H22-O
- MOLECULAR WEIGHT :
- 182.34
- WISWESSER LINE NOTATION :
- L5VTJ B7
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 13,452,1975 ** ACUTE TOXICITY DATA **
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >5 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 13,452,1975
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 5 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 13,452,1975
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Safety Information
| Hazard Codes | Xi |
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| Risk Phrases | R36/37/38 |
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| Safety Phrases | S26-S37 |
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| RTECS | GY4950000 |
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| HS Code | 2914299000 |
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Customs
| HS Code | 2914299000 |
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| Summary | 2914299000. other cyclanic, cyclenic or cyclotherpenic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0% |
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Synonyms
| UNII-4984B2X8AH |
| 2-(n-Heptyl)cyclopentanone |
| 2-HEPTYLCYCLOPENTANONE |
| 2-n-heptylcyclopentanone |
| 2-n-Heptyl cyclopentanone |
| α-Heptyl cyclopentanone |
| Cyclopentanone, 2-heptyl- |
| EINECS 205-273-1 |
| MFCD00019315 |