Introduction：Basic information about CAS 1335-66-6|4,5,6-Trimethyl-3-cyclohexene-1-carbaldehyde, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 4,5,6-Trimethyl-3-cyclohexene-1-carbaldehyde |
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| CAS Number | 1335-66-6 | Molecular Weight | 152.233 |
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| Density | 0.9±0.1 g/cm3 | Boiling Point | 202.6±29.0 °C at 760 mmHg |
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| Molecular Formula | C20H32O2 | Melting Point | / |
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| MSDS | / | Flash Point | 66.7±16.8 °C |
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Names
| Name | Isocyclocitral |
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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 | 202.6±29.0 °C at 760 mmHg |
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| Molecular Formula | C20H32O2 |
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| Molecular Weight | 152.233 |
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| Flash Point | 66.7±16.8 °C |
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| Exact Mass | 152.120117 |
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| PSA | 34.14000 |
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| LogP | 3.16 |
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| Vapour Pressure | 0.3±0.4 mmHg at 25°C |
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| Index of Refraction | 1.496 |
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| InChIKey | AEXLFXYEFLKADK-UHFFFAOYSA-N |
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| SMILES | CC1=CC(C)C(C)C(C=O)C1.CC1=CC(C)C(C=O)C(C)C1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- GW3400000
- CHEMICAL NAME :
- 3-Cyclohexene-1-carboxaldehyde, 2,4,6-trimethyl-, and 3,5,6-trimethyl-3-cyclohexene-1- carboxaldehyde
- CAS REGISTRY NUMBER :
- 1335-66-6
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 4
- MOLECULAR FORMULA :
- C10-H16-O
- MOLECULAR WEIGHT :
- 152.26
- WISWESSER LINE NOTATION :
- L6UTJ A1 C1 D1 EVH &L6UTJ A1 C1 E1 DVH
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: 14,313,1976 ** ACUTE TOXICITY DATA **
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 4500 mg/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: 14,313,1976 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - M4636 No. of Facilities: 982 (estimated) No. of Industries: 10 No. of Occupations: 9 No. of Employees: 7652 (estimated) No. of Female Employees: 1921 (estimated)
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Synonyms
| 3-Cyclohexene-1-carboxaldehyde, 4,5,6-trimethyl- |
| 2,4,6-trimethylcyclohex-3-ene-1-carbaldehyde,3,5,6-trimethylcyclohex-3-ene-1-carbaldehyde |
| 4,5,6-Trimethyl-3-cyclohexene-1-carbaldehyde |
