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| IUPAC name : | 2-(phenylmethyl)-1,3-dioxolane |
| InChI : | InChI=1/C10H12O2/c1-2-4-9(5-3-1)8-10-11-6-7-12-10/h1-5,10H,6-8H2 |
| InChIKey : | SSZACLYPEFCREM-UHFFFAOYAU |
| SMILES : | C1COC(O1)CC2=CC=CC=C2 |
| (EINECS) number : | 202-946-1 |
| cas number : | 101-49-5 |
| beilstein number : | 0117974 |
| molar refractivity : | 46.21 ± 0.3 cm3 |
| parachor : | 380.4 ± 4.0 cm3 |
| index of refraction : | 1.532 ± 0.02 |
| surface tension : | 42.3 ± 3.0 dyne/cm |
| density : | 1.101 ± 0.06 g/cm3 |
| polarizability : | 18.31 ± 0.5 10-24cm3 |
| xlogp : | 1.70 |
| molecular weight : | 164.2010800 |
| formula : | C10 H12 O2 |
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| fda reg : | unspecified |
h. number : | 2911.00.5000 |
| organoleptics : | |
| odor type : | green |
| odor strength : | medium |
odor description :
at 100.00 %. | green waxy sweet hyacinth |
| substantivity : | 72 Hour(s) |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 98.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.08000 - 1.09000 @ 25.00 °C.
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| pounds per gallon - calc. : | 8.987 to 9.070
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| refractive index : | 1.51630 - 1.52630 @ 20.00 °C.
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| boiling point : | 115.00 - 120.00 °C. @ 12.00 mm Hg
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| logp : | 1.46 |
| safety : | |
| Oral Toxicity(LD50) : |
Oral-Rat 2200.00 mg/kg
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| Dermal Toxicity(LD50) : |
Skin-Rabbit 2600.00 mg/kg
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| flash point ( Deg. F. ) : | 226.00 °F. TCC ( 107.78 °C. )
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| recommendation for phenyl acetaldehyde ethylene glycol acetal usage levels up to : |
| | 6.0000 % in the fragrance concentrate.
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| recommendation for phenyl acetaldehyde ethylene glycol acetal usage levels up to : |
| | not for flavor use.
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| safety links : | |
| (EINECS) number : | 202-946-1 |
| rtecs : | JH6768000 for 101-49-5 |
| chemidplus : | 000101495 |
| epa-srs : | 101-49-5 |
| dtp/nci : | 25480 |
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| other : | |
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| references : | |
| pubchem : | 150642 |
| NIST Chemistry WebBook : | 495861766 |
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