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| IUPAC name : | 4-hydroxy-3-methylbenzaldehyde |
| InChI : | InChI=1/C8H8O2/c1-6-4-7(5-9)2-3-8(6)10/h2-5,10H,1H3 |
| InChIKey : | BAKYASSDAXQKKY-UHFFFAOYAM |
| SMILES : | CC1=C(C=CC(=C1)C=O)O |
| cas number : | 15174-69-3 |
| molar refractivity : | 39.71 ± 0.3 cm3 |
| parachor : | 304.9 ± 4.0 cm3 |
| index of refraction : | 1.601 ± 0.02 |
| surface tension : | 48.1 ± 3.0 dyne/cm |
| density : | 1.175 ± 0.06 g/cm3 |
| polarizability : | 15.74 ± 0.5 10-24cm3 |
| xlogp : | 1.50 |
| molecular weight : | 136.1479200 |
| formula : | C8 H8 O2 |
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| export tariff code : | 2912.49.2000 |
| fda reg : | unspecified |
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organoleptics :
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properties :
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| appearence : | tan to brown crystalline powder |
| assay : | 97.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| melting point : | 118.00 to 120.00 °C. @ 760.00 mm Hg
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| boiling point : | 250.00 to 252.00 °C. @ 760.00 mm Hg
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| logp : | 1.85 |
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. ) : | 221.00 °F. TCC ( 105.00 °C. )
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safety references :
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| EPI System : | view |
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| | 4-hydroxy-3-methylbenzaldehyde
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| chemidplus : | 015174693 |
| EPA Substance Registry Services : | 15174-69-3 |
| NLM Chemical Carcinogenesis Research Information System : | 15174-69-3 |
| NLM Developmental and Reproductive Toxicity : | 15174-69-3 |
| NLM Env. Mutagen Info. Center : | 15174-69-3 |
| NLM GENetic TOXicology : | 15174-69-3 |
references :
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| | 4-hydroxy-3-methylbenzaldehyde
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| pubchem : | 716651 |
| NIST Chemistry WebBook : | 3551207446 |
other :
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