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| IUPAC name : | 1,2-dimethoxy-4-methylbenzene |
| InChI : | InChI=1/C9H12O2/c1-7-4-5-8(10-2)9(6-7)11-3/h4-6H,1-3H3 |
| InChIKey : | GYPMBQZAVBFUIZ-UHFFFAOYAG |
| SMILES : | CC1=CC(=C(C=C1)OC)OC |
| (EINECS) number : | 207-796-0 |
| cas number : | 494-99-5 |
| beilstein number : | 2045328 |
| fl. number : | 04.060 |
| molar refractivity : | 44.43 ± 0.3 cm3 |
| parachor : | 358.2 ± 4.0 cm3 |
| index of refraction : | 1.489 ± 0.02 |
| surface tension : | 29.5 ± 3.0 dyne/cm |
| density : | 0.990 ± 0.06 g/cm3 |
| polarizability : | 17.61 ± 0.5 10-24cm3 |
| xlogp : | 2.00 |
| molecular weight : | 152.1903800 |
| formula : | C9 H12 O2 |
| BioActivity Analysis : | 73265 |
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| export tariff code : | 2909.30.4000 |
| fda reg : | unspecified |
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organoleptics :
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properties :
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| assay : | 95.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.05100 @ 25.00 °C.
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| melting point : | 22.00 to 24.00 °C. @ 760.00 mm Hg
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| boiling point : | 219.00 to 220.00 °C. @ 760.00 mm Hg
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| logp : | 2.19 |
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. ) : | 185.00 °F. TCC ( 85.00 °C. )
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| recommendation for 3,4-dimethoxytoluene usage levels up to : |
| | not for fragrance use.
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safety references :
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| EPI System : | view |
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| | 1,2-dimethoxy-4-methylbenzene
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| (EINECS) number : | 207-796-0 |
| chemidplus : | 000494995 |
| EPA Substance Registry Services : | 494-99-5 |
| NLM Chemical Carcinogenesis Research Information System : | 494-99-5 |
| NLM Developmental and Reproductive Toxicity : | 494-99-5 |
| NLM Env. Mutagen Info. Center : | 494-99-5 |
| NLM GENetic TOXicology : | 494-99-5 |
| dtp/nci : | 7378 |
references :
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| | 1,2-dimethoxy-4-methylbenzene
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| fl. number : | 04.060 |
| pubchem : | 210250 |
| NIST Chemistry WebBook : | 960204741 |
other :
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