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| IUPAC name : | 3,5,5-trimethylhexyl formate |
| InChI : | InChI=1/C10H20O2/c1-9(5-6-12-8-11)7-10(2,3)4/h8-9H,5-7H2,1-4H3 |
| InChIKey : | MMANPPDMMOUQIX-UHFFFAOYAE |
| SMILES : | CC(CCOC=O)CC(C)(C)C |
| (EINECS) number : | 266-661-4 |
| cas number : | 67355-38-8 |
| molar refractivity : | 50.23 ± 0.3 cm3 |
| parachor : | 451.0 ± 4.0 cm3 |
| index of refraction : | 1.421 ± 0.02 |
| surface tension : | 27.0 ± 3.0 dyne/cm |
| density : | 0.871 ± 0.06 g/cm3 |
| polarizability : | 19.91 ± 0.5 10-24cm3 |
| xlogp : | 4.10 |
| molecular weight : | 172.2646000 |
| formula : | C10 H20 O2 |
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| fda reg : | unspecified |
h. number : | 2915.13.0000 |
| organoleptics : | |
| odor strength : | medium |
odor description :
at 100.00 %. | woody green herbal |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 98.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| boiling point : | 206.00 - 207.00 °C. @ 760.00 mm Hg
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| logp : | 3.47 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 162.00 °F. TCC ( 72.22 °C. )
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| recommendation for nonisyl formate usage levels up to : | | | 8.0000 % in the fragrance concentrate.
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| safety links : | |
| (EINECS) number : | 266-661-4 |
| chemidplus : | 067355388 |
| epa-srs : | 67355-38-8 |
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| other : | |
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| references : | |
| pubchem : | 683934 |
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| synonyms : |
| | inonyl formate | | | nonisyl formate | | 3,5,5- | trimethyl hexyl formate | | 3,5,5- | trimethyl-1-hexanol formate |
| soluble in : |
| | alcohol |
| insoluble in : |
| | water |
| (odor and/or flavor) used in : |
| | green | | | herbal | | | woody |
| natural occurrence in : |
| not found in nature |
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