| |
| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
| |
|
|
| IUPAC name : | (4-methylphenyl) 2-phenylacetate |
| InChI : | InChI=1/C15H14O2/c1-12-7-9-14(10-8-12)17-15(16)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3 |
| InChIKey : | OJEQSSJFSNLMLB-UHFFFAOYAA |
| SMILES : | CC1=CC=C(C=C1)OC(=O)CC2=CC=CC=C2 |
| (EINECS) number : | 202-990-1 |
| cas number : | 101-94-0 |
| fema number : | 3077 |
| coe number : | 236 |
| jecfa number : | 705 |
| fl. number : | 09.709 |
| molar refractivity : | 66.90 ± 0.3 cm3 |
| parachor : | 518.5 ± 4.0 cm3 |
| index of refraction : | 1.569 ± 0.02 |
| surface tension : | 41.7 ± 3.0 dyne/cm |
| density : | 1.108 ± 0.06 g/cm3 |
| polarizability : | 26.52 ± 0.5 10-24cm3 |
| xlogp : | 3.80 |
| molecular weight : | 226.2704600 |
| formula : | C15 H14 O2 |
| BioActivity Analysis : | 71980 |
|
|
| |
| |
| export tariff code : | 2916.35.1500 |
| fda reg : | unspecified |
| |
Suppliers :
|
| Sigma-Aldrich-SAFC : | p-Tolyl phenylacetate
≥99% |
organoleptics :
|
| odor type : | animal |
| odor strength : | medium , recommend smelling in a 10.00 % solution or less |
odor description : at 10.00 % in dipropylene glycol. | animal rose honey narcissus lily hyacinth |
| substantivity : | 400 Hour(s) |
properties :
|
| appearence : | white crystalline powder |
| assay : | 99.00 to 100.00 %
|
| Food Chemicals Codex Listed : | No |
| melting point : | 74.00 to 76.00 °C. @ 760.00 mm Hg
|
| boiling point : | 310.00 °C. @ 760.00 mm Hg
|
| congealing point : | 73.70
|
| acid value : | 1.00 max. KOH/g
|
| logp : | 3.79 |
| shelf life : | 24.00 month(s) or longer if stored properly. |
| storage : | store in cool, dry place in tightly sealed containers, protected from heat and light. |
safety :
|
| most important hazard(s) : |
None - None |
| Oral Toxicity(LD50) : |
Oral-Rat >5.00 gm/kg FCTXAV 13,775,1975
|
| Dermal Toxicity(LD50) : |
Skin-Rabbit >5.00 gm/kg FCTXAV 13,775,1975
|
| flash point ( Deg. F. ) : | > 230.00 °F. TCC ( > 110.00 °C. )
|
| recommendation for para-cresyl phenyl acetate usage levels up to : |
| | 5.0000 % in the fragrance concentrate.
|
| recommendation for para-cresyl phenyl acetate usage levels up to : |
| | 6.0000 ppm in the flavor.
|
safety links :
|
| msds : | msds |
| |
| |
| (EINECS) number : | 202-990-1 |
| RTECS : | CY1679750 for 101-94-0 |
| chemidplus : | 000101940 |
| EPA Substance Registry Services : | 101-94-0 |
| NLM Chemical Carcinogenesis Research Information System : | 101-94-0 |
| NLM Developmental and Reproductive Toxicity : | 101-94-0 |
| NLM Env. Mutagen Info. Center : | 101-94-0 |
| NLM GENetic TOXicology : | 101-94-0 |
| dtp/nci : | 5981 |
| EPI System : | view |
other :
|
| | C of A |
references :
|
| jecfa number : | 705 |
| fl. number : | 09.709 |
| pubchem : | 197218 |
| NIST Chemistry WebBook : | 753177000 |