Introduction:Basic information about CAS 107-70-0|4-methoxy-4-methyl-2-pentanone, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 4-methoxy-4-methyl-2-pentanone |
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| CAS Number | 107-70-0 | Molecular Weight | 130.18500 |
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| Density | 0,91 g/cm3 | Boiling Point | 156°C |
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| Molecular Formula | C7H14O2 | Melting Point | / |
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| MSDS | USA | Flash Point | 48°C |
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Names
| Name | 4-methoxy-4-methyl-2-pentanone |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0,91 g/cm3 |
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| Boiling Point | 156°C |
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| Molecular Formula | C7H14O2 |
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| Molecular Weight | 130.18500 |
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| Flash Point | 48°C |
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| Exact Mass | 130.09900 |
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| PSA | 26.30000 |
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| LogP | 1.39050 |
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| Vapour Pressure | 2.36mmHg at 25°C |
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| Index of Refraction | 1.405 |
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| InChIKey | KOKPBCHLPVDQTK-UHFFFAOYSA-N |
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| SMILES | COC(C)(C)CC(C)=O |
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| Stability | Stable. Combustible. Incompatible with strong oxidizing agents. |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- SA9185000
- CHEMICAL NAME :
- 2-Pentanone, 4-methoxy-4-methyl-
- CAS REGISTRY NUMBER :
- 107-70-0
- BEILSTEIN REFERENCE NO. :
- 1747866
- LAST UPDATED :
- 199710
- DATA ITEMS CITED :
- 10
- MOLECULAR FORMULA :
- C7-H14-O2
- MOLECULAR WEIGHT :
- 130.21
- WISWESSER LINE NOTATION :
- 1OX1&1&1V1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- SCCUR* Shell Chemical Company. Unpublished Report. (2401 Crow Canyon Rd., San Romon, CA 94583) Volume(issue)/page/year: -,6,1961 ** ACUTE TOXICITY DATA **
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 3 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- SCCUR* Shell Chemical Company. Unpublished Report. (2401 Crow Canyon Rd., San Romon, CA 94583) Volume(issue)/page/year: -,6,1961
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 2050 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- SCCUR* Shell Chemical Company. Unpublished Report. (2401 Crow Canyon Rd., San Romon, CA 94583) Volume(issue)/page/year: -,6,1961
- TYPE OF TEST :
- LCLo - Lowest published lethal concentration
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 2280 ppm/15H
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- SCCUR* Shell Chemical Company. Unpublished Report. (2401 Crow Canyon Rd., San Romon, CA 94583) Volume(issue)/page/year: -,6,1961
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 3 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- SCCUR* Shell Chemical Company. Unpublished Report. (2401 Crow Canyon Rd., San Romon, CA 94583) Volume(issue)/page/year: -,6,1961 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - M1205 No. of Facilities: 3793 (estimated) No. of Industries: 66 No. of Occupations: 53 No. of Employees: 46197 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - M1205 No. of Facilities: 70 (estimated) No. of Industries: 4 No. of Occupations: 12 No. of Employees: 4102 (estimated) No. of Female Employees: 315 (estimated)
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Safety Information
| Hazard Codes | Xn: Harmful; |
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| Risk Phrases | R36;R37;R38 |
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| Safety Phrases | S23-S24/25 |
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| RIDADR | 2293 |
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| RTECS | SA7000000 |
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| Packaging Group | III |
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| Hazard Class | 3 |
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| HS Code | 2914509090 |
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Customs
| HS Code | 2914509090 |
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| Summary | HS:2914509090 other ketones with other oxygen function VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0% |
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Synonyms
| 4-Methoxy-4-methyl-2-pentanone |
| 4-methoxy-4-methylpentan-2-one |
| EINECS 203-512-4 |
| MFCD00043932 |