3-Cyclohexene-1-carboxaldehyde, 4-(4-methyl-3-penten-1-yl)-
PubChem CID: 93199
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| Compound Synonyms | Myrac aldehyde, 37677-14-8, 4-(4-Methyl-3-pentenyl)cyclohex-3-ene-1-carbaldehyde, 3-Cyclohexene-1-carboxaldehyde, 4-(4-methyl-3-pentenyl)-, Isohexenyl cyclohexenyl carboxaldehyde, para-Myrac aldehyde, 4-(4-methylpent-3-en-1-yl)cyclohex-3-ene-1-carbaldehyde, 4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carbaldehyde, 1-Formyl-4-isohexenyl-4-cyclohexene, 4-(4-Methyl-3-pentenyl)-3-cyclohexene-1-carboxaldehyde, Myrac aldehyde 2, EINECS 253-617-4, 1-Formyl-4-ixohexenyl-4-cyclohexene, 4-(4-Methyl-3-penten-1-yl)-3-cyclohexen-1-carboxaldehyde, 4-(4-Methyl-3-penten-1-yl)-3-cyclohexene-1-carboxaldehyde, DTXSID4052051, 3-Cyclohexene-1-carboxaldehyde, 4-(4-methyl-3-penten-1-yl)-, 4-(4-Methylpent-3-enyl)cyclohex-3-ene-1-carboxaldehyde, 3-Cyclohexene-1-carboxaldehyde, 4-(5-methyl-3-penten-1-yl)-, 4-(4-Methyl-3-pentenyl)-3-cyclohexene-1-carbaldehyde, Emfetal, p-Myrac aldehyde, MIRCENAL, SCHEMBL214415, DTXCID5030618, CHEBI:192311, BCP29789, AKOS006230340, DA-42604, LS-14240, ISOHEXENYL CYCLOPENTENYL CARBALDEHYDE, CS-0199114, NS00012703, F71271, 4-(4-methylpent-3-enyl)cyclohex-3-enecarbaldehyde, 4-(4-Methyl-3-penten-1-yl)-3-cyclohexen1- carboxaldehyde, 253-617-4, Isohexenyl cyclohexenyl carboxaldehyde pound>>4-(4-Methyl-3-pentenyl)cyclohex-3-ene-1-carbaldehyde |
|---|---|
| Topological Polar Surface Area | 17.1 |
| Hydrogen Bond Donor Count | 0.0 |
| Inchi Key | MQBIZQLCHSZBOI-UHFFFAOYSA-N |
| Rotatable Bond Count | 4.0 |
| Synonyms | 4-(4-Methyl-3-pentenyl)-3-cyclohexene-1-carbaldehyde, 4-(4-Methyl-3-pentenyl)-3-cyclohexene-1-carboxaldehyde |
| Heavy Atom Count | 14.0 |
| Compound Name | 3-Cyclohexene-1-carboxaldehyde, 4-(4-methyl-3-penten-1-yl)- |
| Description | It is used in flavouring formulations. |
| Exact Mass | 192.151 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 192.151 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 244.0 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 192.3 |
| Database Name | fooddb_chem_all;pubchem |
| Covalent Unit Count | 1.0 |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carbaldehyde |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Inchi | InChI=1S/C13H20O/c1-11(2)4-3-5-12-6-8-13(10-14)9-7-12/h4,6,10,13H,3,5,7-9H2,1-2H3 |
| Smiles | CC(=CCCC1=CCC(CC1)C=O)C |
| Xlogp | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
| Molecular Formula | C13H20O |
- 1. Outgoing r'ship
FOUND_INto/from Camellia Sinensis (Plant) Rel Props:Source_db:fooddb_chem_all