11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene

C24H32O6 — CID 3355803

IUPAC11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene
SMILESCCc1ccc2c(c1)OCCOCCOc1ccc(CC)cc1OCCOCCO2
InChIInChI=1S/C24H32O6/c1-3-19-5-7-21-23(17-19)29-15-11-25-10-14-28-22-8-6-20(4-2)18-24(22)30-16-12-26-9-13-27-21/h5-8,17-18H,3-4,9-16H2,1-2H3
InChIKeyQIHARHPAWQXEFL-UHFFFAOYSA-N
MW416.51 g/mol
LogP4.07
Rot. Bonds2

About 11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene

11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene (PubChem CID 3355803) has the molecular formula C24H32O6 and a molecular weight of 416.51 g/mol. Its IUPAC name is 11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene.

Molecular Properties

Compound Name11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene
PubChem CID3355803
Molecular FormulaC24H32O6
Molecular Weight416.51 g/mol
Exact Mass416.22
IUPAC Name11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene
SMILESCCc1ccc2c(c1)OCCOCCOc1ccc(CC)cc1OCCOCCO2
InChIInChI=1S/C24H32O6/c1-3-19-5-7-21-23(17-19)29-15-11-25-10-14-28-22-8-6-20(4-2)18-24(22)30-16-12-26-9-13-27-21/h5-8,17-18H,3-4,9-16H2,1-2H3
InChIKeyQIHARHPAWQXEFL-UHFFFAOYSA-N
XLogP4.07
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.51
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene with MolForge

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Related Compounds

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CID 23636185
20-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)-2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-triene
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3-O-[[24-[(3-ethoxy-3-oxopropanoyl)oxymethyl]-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaen-11-yl]methyl] 1-O-ethyl propanedioate
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Frequently Asked Questions

What is the IUPAC name of 11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene?
The IUPAC name of 11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene (CID 3355803) is 11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene.
What is the SMILES notation for 11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene?
The canonical SMILES for 11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene is CCc1ccc2c(c1)OCCOCCOc1ccc(CC)cc1OCCOCCO2.
What is the InChIKey of 11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene?
The InChIKey is QIHARHPAWQXEFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32O6/c1-3-19-5-7-21-23(17-19)29-15-11-25-10-14-28-22-8-6-20(4-2)18-24(22)30-16-12-26-9-13-27-21/h5-8,17-18H,3-4,9-16H2,1-2H3.
What are the key properties of 11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene?
11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene has a molecular weight of 416.51 g/mol, XLogP of 4.07, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene is sourced from PubChem (CID 3355803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).