| |
| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
| |
|
|
| IUPAC name : | 4-tert-butylphenol |
| InChI : | InChI=1/C10H14O/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7,11H,1-3H3 |
| InChIKey : | QHPQWRBYOIRBIT-UHFFFAOYAM |
| SMILES : | CC(C)(C)C1=CC=C(C=C1)O |
| (EINECS) number : | 202-679-0 |
| cas number : | 98-54-4 |
| beilstein number : | 1817334 |
| fema number : | 3918 |
| jecfa number : | 733 |
| fl. number : | 04.064 |
| molar refractivity : | 46.52 ± 0.3 cm3 |
| parachor : | 370.3 ± 4.0 cm3 |
| index of refraction : | 1.513 ± 0.02 |
| surface tension : | 32.9 ± 3.0 dyne/cm |
| density : | 0.971 ± 0.06 g/cm3 |
| polarizability : | 18.44 ± 0.5 10-24cm3 |
| xlogp : | 3.40 |
| molecular weight : | 150.2175600 |
| formula : | C10 H14 O |
| BioActivity Analysis : | 70137 |
|
|
| |
| |
| export tariff code : | unspecified |
| fda reg : | unspecified |
| |
Suppliers :
|
| Sigma-Aldrich-SAFC : | 4-tert-Butyl phenol |
| | ≥99% |
| |
| |
organoleptics :
|
| odor type : | leathery |
| odor strength : | high , recommend smelling in a 1.00 % solution or less |
odor description : at 1.00 % in propylene glycol. | oakmoss leather |
properties :
|
| appearence : | colorless to amber powder |
| assay : | 99.00 - 100.00 %
|
| Food Chemicals Codex Listed : | No |
| melting point : | 98.00 - 101.00 °C. @ 760.00 mm Hg
|
| boiling point : | 236.00 - 238.00 °C. @ 760.00 mm Hg
|
| logp : | 3.31 |
safety :
|
| most important hazard(s) : |
Xi N - Irritant, Dangerous for the environment. |
| | |
| Oral Toxicity(LD50) : |
Oral-Rat 3250.00 ul/kg
|
| Dermal Toxicity(LD50) : |
Skin-Rabbit 2520.00 ul/kg
|
| | |
| flash point ( Deg. F. ) : | > 200.00 °F. TCC ( > 93.33 °C. )
|
| | |
| IFRA critical Effect : | Sensitization and depigmentation |
| recommendation for 4-tert-butyl phenol usage levels up to : |
| | PROHIBITED : Should not be used as a fragrance ingredient.
|
| | |
safety links :
|
| (EINECS) number : | 202-679-0 |
| rtecs : | SJ8925000 for 98-54-4 |
| chemidplus : | 000098544 |
| epa-srs : | 98-54-4 |
| dtp/nci : | 3697 |
| | |
| EPI System : | Click here |
| ifra : | ifra - ( Found under : p-tert-Butylphenol ) |
other :
|
| |
|
references :
|
| jecfa number : | 733 |
| fl. number : | 04.064 |
| pubchem : | 150457 |
| NIST Chemistry WebBook : | 2098037944 |
| | |