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| IUPAC name : | ethenylbenzene |
| InChI : | InChI=1/C8H8/c1-2-8-6-4-3-5-7-8/h2-7H,1H2 |
| InChIKey : | PPBRXRYQALVLMV-UHFFFAOYAB |
| SMILES : | C=CC1=CC=CC=C1 |
| (EINECS) number : | 202-851-5 |
| eu annex : | 601-026-00-0 |
| cas number : | 100-42-5 |
| fema number : | 3233 |
| coe number : | 11022 |
| fl. number : | 01.015 |
| molar refractivity : | 37.17 ± 0.3 cm3 |
| parachor : | 272.2 ± 4.0 cm3 |
| index of refraction : | 1.557 ± 0.02 |
| surface tension : | 30.9 ± 3.0 dyne/cm |
| density : | 0.902 ± 0.06 g/cm3 |
| polarizability : | 14.73 ± 0.5 10-24cm3 |
| xlogp : | 3.00 |
| molecular weight : | 104.1491200 |
| formula : | C8 H8 |
| BioActivity Analysis : | 17389731 |
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| fda reg : | 172.515 173.20 173.25 175.105 175.300 175.320 175.380 175.390 176.170 176.180 177.1010 177.1020 177.1030 177.1040 177.1050 177.1210 177.1630 177.1640 177.1810 177.1820 177.1830 177.2260 177.2420 177.2420 177.2600 177.2710 177.2800 178.3790 |
h. number : | 2902.50.0000 |
| organoleptics : | |
| odor type : | balsamic |
| odor strength : | high , recommend smelling in a 0.10 % solution or less |
odor description : at 0.10 % in triacetin. | sweet balsam floral plastic |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 99.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.90900 @ 25.00 °C.
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| refractive index : | 1.54700 @ 20.00 °C.
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| melting point : | -31.00 - -30.00 °C. @ 760.00 mm Hg
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| boiling point : | 145.00 - 146.00 °C. @ 760.00 mm Hg
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| boiling point : | 67.00 - 68.00 °C. @ 50.00 mm Hg
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| logp : | 2.95 |
| safety : | |
| Oral Toxicity(LD50) : |
Oral-Rat 2650.00 mg/kg
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 88.00 °F. TCC ( 31.11 °C. )
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| recommendation for styrene usage levels up to : |
| | not for fragrance use.
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| safety links : | |
| (EINECS) number : | 202-851-5 |
| rtecs : | WL3675000 for 100-42-5 |
| chemidplus : | 000100425 |
| epa-srs : | 100-42-5 |
| dtp/nci : | 62785 |
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| other : | |
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| references : | |
| pubchem : | 150575 |
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