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| IUPAC name : | heptan-4-ol |
| InChI : | InChI=1/C7H16O/c1-3-5-7(8)6-4-2/h7-8H,3-6H2,1-2H3 |
| InChIKey : | YVBCULSIZWMTFY-UHFFFAOYAT |
| SMILES : | CCCC(CCC)O |
| (EINECS) number : | 209-651-7 |
| cas number : | 589-55-9 |
| coe number : | 555 |
| fl. number : | 02.046 |
| molar refractivity : | 35.97 ± 0.3 cm3 |
| parachor : | 324.7 ± 4.0 cm3 |
| index of refraction : | 1.420 ± 0.02 |
| surface tension : | 27.3 ± 3.0 dyne/cm |
| density : | 0.818 ± 0.06 g/cm3 |
| polarizability : | 14.26 ± 0.5 10-24cm3 |
| xlogp : | 2.20 |
| molecular weight : | 116.2013400 |
| formula : | C7 H16 O |
| BioActivity Analysis : | 74313 |
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| fda reg : | unspecified |
h. number : | unspecified |
| organoleptics : | |
| odor strength : | medium |
odor description :
at 100.00 %. | alcoholic |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 99.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| boiling point : | 156.00 - 158.00 °C. @ 760.00 mm Hg
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| logp : | 2.22 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 118.00 °F. TCC ( 47.78 °C. )
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| recommendation for 4-heptanol usage levels up to : |
| | not for fragrance use.
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| safety links : | |
| (EINECS) number : | 209-651-7 |
| chemidplus : | 000589559 |
| epa-srs : | 589-55-9 |
| dtp/nci : | 8695 |
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| other : | |
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| references : | |
| pubchem : | 154817 |
| NIST Chemistry WebBook : | 2964191787 |
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