Introduction：Basic information about CAS 6812-78-8|(3S)-3,7-dimethyloct-7-en-1-ol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (3S)-3,7-dimethyloct-7-en-1-ol |
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| CAS Number | 6812-78-8 | Molecular Weight | 380.76500 |
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| Density | 0.865 g/mL at 25ºC(lit.) | Boiling Point | 68-70ºC1.8 mm Hg(lit.) |
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| Molecular Formula | C10H13ClN6O6S | Melting Point | / |
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| MSDS | / | Flash Point | 210 °F |
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Names
| Name | (3S)-3,7-dimethyloct-7-en-1-ol |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.865 g/mL at 25ºC(lit.) |
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| Boiling Point | 68-70ºC1.8 mm Hg(lit.) |
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| Molecular Formula | C10H13ClN6O6S |
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| Molecular Weight | 380.76500 |
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| Flash Point | 210 °F |
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| Exact Mass | 380.03100 |
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| PSA | 197.08000 |
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| LogP | 0.26350 |
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| Index of Refraction | n20/D 1.469(lit.) |
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| InChIKey | JGQFVRIQXUFPAH-JTQLQIEISA-N |
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| SMILES | C=C(C)CCCC(C)CCO |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- RH3413000
- CHEMICAL NAME :
- 7-Octen-1-ol, 3,7-dimethyl-, (S)-
- CAS REGISTRY NUMBER :
- 6812-78-8
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 4
- MOLECULAR FORMULA :
- C10-H20-O
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LDLo - Lowest published lethal dose
- 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 :
- FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 30,113S,1992
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intramuscular
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 4 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JSICAZ Journal of Scientific and Industrial Research, Section C: Biological Sciences. (New Delhi, India) V.14-21, 1955-62. For publisher information, see IJEBA6. Volume(issue)/page/year: 21,342,1962
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 3600 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 30,113S,1992
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Safety Information
| Hazard Codes | Xi |
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| Safety Phrases | 26-36 |
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Synonyms
| 3,7-dimethyl-7-octen-1-ol |
| (S)-3,7-Dimethyl-7-octen-1-ol |
| 3,7-dimethyl-7-octenol |
| Rhodinol,(-) |
| 7-Octen-1-ol,3,7-dimethyl-,(S) |
| EINECS 229-887-4 |
| 1-citronellol |
| FEMA No. 2980 |
| 3,7-dimethyl-oct-7-en-1-ol |
| 1-hydroxy-3,7-dimethyl-7-octene |
| Rhodinol (natural) |
