Introduction:Basic information about CAS 8013-90-9|Ionone, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Ionone |
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| CAS Number | 8013-90-9 | Molecular Weight | 192.297 |
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| Density | 0.9±0.1 g/cm3 | Boiling Point | 254.8±0.0 °C at 760 mmHg |
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| Molecular Formula | C13H20O | Melting Point | / |
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| MSDS | / | Flash Point | 121.3±11.9 °C |
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Names
| Name | 4-(2,6,6-Trimethylcyclohex-1-en-1-yl)but-3-en-2-one |
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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 | 254.8±0.0 °C at 760 mmHg |
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| Molecular Formula | C13H20O |
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| Molecular Weight | 192.297 |
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| Flash Point | 121.3±11.9 °C |
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| Exact Mass | 192.151413 |
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| PSA | 34.14000 |
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| LogP | 3.85 |
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| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
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| Index of Refraction | 1.518 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- NO0700000
- CHEMICAL NAME :
- Ionone
- CAS REGISTRY NUMBER :
- 8013-90-9
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 6
- MOLECULAR FORMULA :
- C13-H20-O
- MOLECULAR WEIGHT :
- 192.33
- WISWESSER LINE NOTATION :
- L6UTJ A1 E1 E1 F1U1V1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 4590 mg/kg
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity) Behavioral - tremor
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 2605 mg/kg
- TOXIC EFFECTS :
- Behavioral - anticonvulsant Behavioral - sleep
MUTATION DATA - TYPE OF TEST :
- DNA repair
- TEST SYSTEM :
- Bacteria - Bacillus subtilis
- DOSE/DURATION :
- 19 mg/disc
- REFERENCE :
- OIGZDE Osaka-shi Igakkai Zasshi. Journal of Osaka City Medical Association. (Osaka-shi Igakkai, c/o Osaka-shiritsu Daigaku Igakubu, 1-4-54 Asahi-cho, Abeno-ku, Osaka, 545, Japan) V.24- 1975- Volume(issue)/page/year: 34,267,1985 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 83201 No. of Facilities: 92 (estimated) No. of Industries: 5 No. of Occupations: 36 No. of Employees: 7567 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 83201 No. of Facilities: 1286 (estimated) No. of Industries: 31 No. of Occupations: 34 No. of Employees: 40007 (estimated) No. of Female Employees: 11154 (estimated)
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Safety Information
| Hazard Codes | N |
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| RTECS | NO0700000 |
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| HS Code | 2914230000 |
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Customs
| HS Code | 2914230000 |
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| Summary | 2914230000 (e)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。Lowest tariff:5.5%。General tariff:30.0% |
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Synonyms
| MFCD00167092 |
| EINECS 232-396-8 |
| Ionone |