3-Chloro-4,6-dihydroxy-2-methyl-5-[(2E,4E)-3-methyl-5-[(1R,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]-2,4-pentadien-1-yl]benzaldehyde
CAS Registry Number®
26166-39-2
CAS Name
3-Chloro-4,6-dihydroxy-2-methyl-5-[(2E,4E)-3-methyl-5-[(1R,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]-2,4-pentadien-1-yl]benzaldehydeMolecular Formula
C23H29ClO4Molecular Mass
404.93Cite this Page
3-Chloro-4,6-dihydroxy-2-methyl-5-[(2E,4E)-3-methyl-5-[(1R,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]-2,4-pentadien-1-yl]benzaldehyde. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=26166-39-2 (retrieved ) (CAS RN: 26166-39-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
172-174 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C23H29ClO4/c1-13(10-11-23(5)14(2)7-9-19(26)16(23)4)6-8-17-21(27)18(12-25)15(3)20(24)22(17)28/h6,10-12,14,16,27-28H,7-9H2,1-5H3/b11-10+,13-6+/t14-,16+,23+/m1/s1
InChIKey
InChIKey=SETVRSKZJJWOPA-FLDGXQSCSA-N
SMILES
C(/C=C(/C=C/[C@]1(C)[C@@H](C)C(=O)CC[C@H]1C)\C)C2=C(O)C(C=O)=C(C)C(Cl)=C2O
Canonical SMILES
O=CC1=C(O)C(=C(O)C(Cl)=C1C)CC=C(C=CC2(C)C(C(=O)CCC2C)C)C
Other Names for this Substance
- Benzaldehyde, 3-chloro-4,6-dihydroxy-2-methyl-5-[(2E,4E)-3-methyl-5-[(1R,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]-2,4-pentadien-1-yl]-
- β-Resorcylaldehyde, 5-chloro-6-methyl-3-[3-methyl-5-(1,2,6-trimethyl-3-oxocyclohexyl)-2,4-pentadienyl]-, (E,E)-
- Benzaldehyde, 3-chloro-4,6-dihydroxy-2-methyl-5-[3-methyl-5-(1,2,6-trimethyl-3-oxocyclohexyl)-2,4-pentadienyl]-, [1R-[1α(2E,4E),2β,6β]]-
- Benzaldehyde, 3-chloro-4,6-dihydroxy-2-methyl-5-[(2E,4E)-3-methyl-5-[(1R,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]-2,4-pentadienyl]-
- 3-Chloro-4,6-dihydroxy-2-methyl-5-[(2E,4E)-3-methyl-5-[(1R,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]-2,4-pentadien-1-yl]benzaldehyde
Deleted or Replaced CAS Registry Numbers
12689-10-0, 22562-66-9
