para-anisyl isothiocyanate
4-methoxyphenyl isothiocyanate
Identification
| Name | para-anisyl isothiocyanate |
| IUPAC | 1-isothiocyanato-4-methoxybenzene |
| CAS Number | 2284-20-0 |
| EINECS | 218-921-3 |
| FDA UNII | Search |
| Molecular Formula | C8 H7 N O S |
| Molecular Weight | 165.21499000 |
| MDL Number | MFCD00011676 |
| Nikkaji Number | J213.163C |
| Beilstein | 606967 |
| XlogP3 | 3.60 (est) |
Regulatory
Physical Properties
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 1.18200 to 1.18700 @ 20.00 °C. |
| Pounds per Gallon - (est). | 9.847 to 9.889 |
| Refractive Index | 1.64600 to 1.65100 @ 20.00 °C. |
| Melting Point | 18.00 °C. @ 760.00 mm Hg |
| Boiling Point | 280.50 °C. @ 760.00 mm Hg |
| Flash Point | > 230.00 °F. TCC ( > 110.00 °C. ) |
| logP (o/w) | 3.580 |
| Soluble in | water, 56.75 mg/L @ 25 °C (est) |
No sensory data available
Safety Information
| Preferred SDS | View |
| Oral/Parenteral Toxicity | Not determined |
| Dermal Toxicity | Not determined |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | information only not used for fragrances or flavors |
| Recommendation for para-anisyl isothiocyanate usage levels up to | not for fragrance use. |
| Recommendation for para-anisyl isothiocyanate flavor usage levels up to | not for flavor use. |
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Potential Uses
Natural Occurrence
Synonyms
p-
anisyl isothiocyanate
4-
methoxyphenyl isothiocyanate
p-
methoxyphenyl isothiocyanate
4-
methoxyphenylisothiocyanate
1-iso
thiocyanato-4-methoxybenzene
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