2,6,6-trimethylcyclohexene-1-carbaldehyde (Click)
IUPAC Name :2,6,6-trimethylcyclohexene-1-carbaldehyde
Std.InChI :InChI=1S/C10H16O/c1-8-5-4-6-10(2,3)9(8)7-11/h7H,4-6H2,1-3H3
InChI :InChI=1/C10H16O/c1-8-5-4-6-10(2,3)9(8)7-11/h7H,4-6H2,1-3H3
Std.InChIKey :MOQGCGNUWBPGTQ-UHFFFAOYSA-N
InChIKey :MOQGCGNUWBPGTQ-UHFFFAOYAR
SMILES :CC1=C(C(CCC1)(C)C)C=O
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| CAS Number : | 432-25-7 |
| ESIS EC# (EINECS) : | 207-081-3 |
| CoE Number : | 11849 |
| XlogP3-AA : | 2.40 (est) |
| Molecular Weight : | 152.23672000 |
| Formula : | C10 H16 O |
| NMR Predictor : | Predict |
| Category : | flavor and fragrance agents |
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| JECFA Food Flavoring : | 979 2,6,6-trimethyl-1&2-cyclohexen-1-carboxaldehyde |
| FEMA Number : | 3639 2,6,6-trimethyl-1&2-cyclohexen-1-carboxaldehyde |
| FDA Mainterm : | 2,6,6-TRIMETHYL-1 AND 2-CYCLOHEXEN-1-CARBOXALDEHYDE |
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2,6,6−trimethylcyclohexene−1−carbaldehyde
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| Synonyms : |
| .beta.- | cyclocitral | | alpha & beta- | cyclocitral | | b- | cyclocitral | | beta- | cyclocitral | | 1- | cyclohexene−1−carboxaldehyde, 2,6,6−trimethyl− | | | cyclohexenecarboxaldehyde, 2,6,6−trimethyl− | | 2,6,6- | trimethyl cyclohexene−1−carbaldehyde | | 2,6,6- | trimethyl−1−cyclohexen−1−carboxaldehyde | | 2,6,6- | trimethyl−1−cyclohexene−1−carbaldehyde | | 2,6,6- | trimethyl−1−cyclohexene−1−carboxaldehyde | | 2,6,6- | trimethyl−1(2)−cyclohexen−1−carboxaldehyde | | 2,6,6- | trimethyl−1&2−cyclohexen−1−carboxaldehyde | | 2,6,6- | trimethylcyclohex−1−ene−1−carbaldehyde | | 2,6,6- | trimethylcyclohexene−1−carbaldehyde | | 2,6,6- | trimethylcyclohexenecarbaldehyde |
| Soluble in : |
| | alcohol | | | water, 86.14 mg/L @ 25 °C (est) |
| Insoluble in : |
| | water |
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