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| IUPAC name : | 6-propan-2-ylquinoline |
| InChI : | InChI=1/C12H13N/c1-9(2)10-5-6-12-11(8-10)4-3-7-13-12/h3-9H,1-2H3 |
| InChIKey : | NKCQEIXYLHACJC-UHFFFAOYAW |
| SMILES : | CC(C)C1=CC2=C(C=C1)N=CC=C2 |
| (EINECS) number : | 205-220-2 |
| cas number : | 135-79-5 |
| molar refractivity : | 56.37 ± 0.3 cm3 |
| parachor : | 420.2 ± 4.0 cm3 |
| index of refraction : | 1.590 ± 0.02 |
| surface tension : | 40.2 ± 3.0 dyne/cm |
| density : | 1.026 ± 0.06 g/cm3 |
| polarizability : | 22.34 ± 0.5 10-24cm3 |
| xlogp : | 3.50 |
| molecular weight : | 171.2383200 |
| formula : | C12 H13 N |
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| IUPAC name : | 8-propan-2-ylquinoline |
| InChI : | InChI=1/C12H13N/c1-9(2)11-7-3-5-10-6-4-8-13-12(10)11/h3-9H,1-2H3 |
| InChIKey : | FAHUZGNYQXPESZ-UHFFFAOYAW |
| SMILES : | CC(C)C1=CC=CC2=C1N=CC=C2 |
| (EINECS) number : | 229-264-7 |
| cas number : | 6457-30-3 |
| molar refractivity : | 56.37 ± 0.3 cm3 |
| parachor : | 420.2 ± 4.0 cm3 |
| index of refraction : | 1.590 ± 0.02 |
| surface tension : | 40.2 ± 3.0 dyne/cm |
| density : | 1.026 ± 0.06 g/cm3 |
| polarizability : | 22.34 ± 0.5 10-24cm3 |
| xlogp : | 3.30 |
| molecular weight : | 171.2383200 |
| formula : | C12 H13 N |
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| fda reg : | unspecified |
h. number : | 2933.40.7050 |
| organoleptics : | |
| odor type : | green |
| odor strength : | high , recommend smelling in a 1.00 % solution or less |
odor description : at 1.00 % in dipropylene glycol. | weedy green metallic earthy leafy cortex |
| substantivity : | 320 Hour(s) |
| properties : | |
| appearence : | yellow to brownish yellow liquid |
| assay : | 98.00 - 100.00 % sum of isomers
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.01900 - 1.02500 @ 25.00 °C.
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| pounds per gallon - calc. : | 8.479 to 8.529
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| refractive index : | 1.58600 - 1.59300 @ 20.00 °C.
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| boiling point : | 100.00 °C. @ 0.50 mm Hg
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| logp : | 3.42 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 196.00 °F. TCC ( 91.11 °C. )
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| recommendation for isopropyl quinoline usage levels up to : |
| | 2.0000 % in the fragrance concentrate.
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| recommendation for isopropyl quinoline usage levels up to : |
| | not for flavor use.
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| safety links : | |
| (EINECS) number : | 205-220-2 |
| chemidplus : | 000135795 |
| epa-srs : | 135-79-5 |
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| (EINECS) number : | 229-264-7 |
| chemidplus : | 006457303 |
| epa-srs : | 6457-30-3 |
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| other : | |
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| references : | |
| pubchem : | 209392 |
| NIST Chemistry WebBook : | 2653439816 |
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| pubchem : | 657894 |
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