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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | (2-methyl-5-propan-2-ylphenyl) acetate |
| InChI : | InChI=1/C12H16O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h5-8H,1-4H3 |
| InChIKey : | OXZSUQJHKQOGOK-UHFFFAOYAZ |
| SMILES : | CC1=C(C=C(C=C1)C(C)C)OC(=O)C |
| (EINECS) number : | 228-963-4 |
| cas number : | 6380-28-5 |
| fl. number : | 09.337 |
| molar refractivity : | 56.60 ± 0.3 cm3 |
| parachor : | 461.4 ± 4.0 cm3 |
| index of refraction : | 1.497 ± 0.02 |
| surface tension : | 32.4 ± 3.0 dyne/cm |
| density : | 0.994 ± 0.06 g/cm3 |
| polarizability : | 22.43 ± 0.5 10-24cm3 |
| xlogp : | 3.40 |
| molecular weight : | 192.2542400 |
| formula : | C12 H16 O2 |
| BioActivity Analysis : | 72566 |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
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organoleptics :
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properties :
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| assay : | 96.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| refractive index : | 1.48900 to 1.49500 @ 20.00 °C.
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| melting point : | 29.00 to 30.00 °C. @ 760.00 mm Hg
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| boiling point : | 245.00 to 247.00 °C. @ 760.00 mm Hg
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| logp : | 3.59 |
safety :
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| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 202.00 °F. TCC ( 94.44 °C. )
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safety links :
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| (EINECS) number : | 228-963-4 |
| chemidplus : | 004395828 |
| EPA Substance Registry Services : | 6380-28-5 |
| NLM Chemical Carcinogenesis Research Information System : | 6380-28-5 |
| NLM Developmental and Reproductive Toxicity : | 6380-28-5 |
| NLM Env. Mutagen Info. Center : | 6380-28-5 |
| NLM GENetic TOXicology : | 6380-28-5 |
| dtp/nci : | 6601 |
| EPI System : | view |
other :
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references :
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| fl. number : | 09.337 |
| pubchem : | 714622 |
| NIST Chemistry WebBook : | 333034488 |