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| IUPAC name : | di(phenyl)methanone |
| InChI : | InChI=1/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H |
| InChIKey : | RWCCWEUUXYIKHB-UHFFFAOYAX |
| SMILES : | C1=CC=C(C=C1)C(=O)C2=CC=CC=C2 |
| (EINECS) number : | 204-337-6 |
| cas number : | 119-61-9 |
| fema number : | 2134 |
| coe number : | 166 |
| jecfa number : | 831 |
| fl. number : | 07.032 |
| molar refractivity : | 56.04 ± 0.3 cm3 |
| parachor : | 426.9 ± 4.0 cm3 |
| index of refraction : | 1.583 ± 0.02 |
| surface tension : | 42.1 ± 3.0 dyne/cm |
| density : | 1.087 ± 0.06 g/cm3 |
| polarizability : | 22.21 ± 0.5 10-24cm3 |
| xlogp : | 3.60 |
| molecular weight : | 182.2179000 |
| formula : | C13 H10 O |
| BioActivity Analysis : | 73790 |
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| fda reg : | 172.515 177.2600 |
h. number : | 2914.39.90 |
| organoleptics : | |
| odor type : | balsamic |
| odor strength : | medium , recommend smelling in a 10.00 % solution or less |
odor description : at 10.00 % in dipropylene glycol. | balsam rose metallic powdery geranium |
| substantivity : | 394 hour(s) at 100.00 % |
| properties : | |
| appearence : | white crystalline solid |
| assay : | 99.00 - 100.00 %
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| Food Chemicals Codex Listed : | Yes |
| melting point : | 47.00 - 51.00 °C. @ 760.00 mm Hg
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| boiling point : | 305.00 - 307.00 °C. @ 760.00 mm Hg
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| boiling point : | 170.00 - 171.00 °C. @ 15.00 mm Hg
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| logp : | 3.18 |
| shelf life : | 36.00 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) : |
Xi N - Irritant, Dangerous for the environment. |
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| Oral Toxicity(LD50) : |
Oral-Rat >10.00 gm/kg FCTXAV 11,873,1973
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| Dermal Toxicity(LD50) : |
Skin-Rabbit 3535.00 mg/kg FCTXAV 11,873,1973
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| flash point ( Deg. F. ) : | > 212.00 °F. TCC ( > 100.00 °C. )
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| recommendation for benzophenone usage levels up to : |
| | 6.0000 % in the fragrance concentrate.
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| recommendation for benzophenone usage levels up to : |
| | 2.0000 ppm in the flavor.
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| safety links : | |
| msds : | msds |
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| (EINECS) number : | 204-337-6 |
| rtecs : | DI9950000 for 119-61-9 |
| chemidplus : | 000119619 |
| epa-srs : | 119-61-9 |
| dtp/nci : | 8077 |
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| other : | |
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C of A
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| references : | |
| pubchem : | 151552 |
| NIST Chemistry WebBook : | 1073705171 |
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