9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene

C18H32O6Si2 — CID 139169771

IUPAC9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene
SMILESC[Si]1(C)OCCOCCOc2ccccc2OCCOCCO[Si]1(C)C
InChIInChI=1S/C18H32O6Si2/c1-25(2)23-15-11-19-9-13-21-17-7-5-6-8-18(17)22-14-10-20-12-16-24-26(25,3)4/h5-8H,9-16H2,1-4H3
InChIKeySFQNSOHBCSQNGA-UHFFFAOYSA-N
MW400.62 g/mol
LogP3.01
Rot. Bonds

About 9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene

9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene (PubChem CID 139169771) has the molecular formula C18H32O6Si2 and a molecular weight of 400.62 g/mol. Its IUPAC name is 9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene.

Molecular Properties

Compound Name9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene
PubChem CID139169771
Molecular FormulaC18H32O6Si2
Molecular Weight400.62 g/mol
Exact Mass400.17
IUPAC Name9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene
SMILESC[Si]1(C)OCCOCCOc2ccccc2OCCOCCO[Si]1(C)C
InChIInChI=1S/C18H32O6Si2/c1-25(2)23-15-11-19-9-13-21-17-7-5-6-8-18(17)22-14-10-20-12-16-24-26(25,3)4/h5-8H,9-16H2,1-4H3
InChIKeySFQNSOHBCSQNGA-UHFFFAOYSA-N
XLogP3.01
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.62
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene with MolForge

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Related Compounds

2,5,8,11,14,17,20,23,26,29,36,39,42,45,48,51,54,57,60,63-icosaoxatricyclo[62.4.0.030,35]octahexaconta-1(68),30,32,34,64,66-hexaene
CID 18784255
2,3,5,6-tetrahydro-1,4,7-benzotrioxonine
CID 585925
2,5,8,11,14,21,24,27,30,33-decaoxatricyclo[32.4.0.015,20]octatriaconta-1(38),15,17,19,34,36-hexaene;2,5,8,15,18,21,24-heptaoxatricyclo[23.4.0.09,14]nonacosa-1(29),9,11,13,25,27-hexaene;2,5,8,11,18,21,24,27-octaoxatricyclo[26.4.0.012,17]dotriaconta-1(32),12,14,16,28,30-hexaene
CID 161330562
2,5,8,15,18,21,24-heptaoxatricyclo[23.4.0.09,14]nonacosa-1(29),9,11,13,25,27-hexaene
CID 585932
2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(26),9,11,13,22,24-hexaene
CID 139075381
molecular iodine;2,5,8,11,18,21,24,27-octaoxatricyclo[26.4.0.012,17]dotriaconta-1(32),12,14,16,28,30-hexaene
CID 139040495
2,9,16,19,22,25,28,31-octaoxatetracyclo[30.4.0.03,8.010,15]hexatriaconta-1(36),3,5,7,10,12,14,32,34-nonaene
CID 19391907
2,5,9,12-tetraoxabicyclo[11.4.0]heptadeca-1(17),13,15-triene
CID 13401373
2,5,8,11,14,18-hexaoxabicyclo[17.4.0]tricosa-1(23),19,21-triene
CID 22411101
3,10,13,16,19,26-hexaoxatetracyclo[26.2.2.04,9.020,25]dotriaconta-1(31),4,6,8,20,22,24,28(32),29-nonaene
CID 139077426
(6Z)-2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(22),6,18,20-tetraene
CID 163774799
ethanethioamide;2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(19),15,17-triene
CID 71405189

Frequently Asked Questions

What is the IUPAC name of 9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene?
The IUPAC name of 9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene (CID 139169771) is 9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene.
What is the SMILES notation for 9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene?
The canonical SMILES for 9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene is C[Si]1(C)OCCOCCOc2ccccc2OCCOCCO[Si]1(C)C.
What is the InChIKey of 9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene?
The InChIKey is SFQNSOHBCSQNGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32O6Si2/c1-25(2)23-15-11-19-9-13-21-17-7-5-6-8-18(17)22-14-10-20-12-16-24-26(25,3)4/h5-8H,9-16H2,1-4H3.
What are the key properties of 9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene?
9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene has a molecular weight of 400.62 g/mol, XLogP of 3.01, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9,10,10-tetramethyl-2,5,8,11,14,17-hexaoxa-9,10-disilabicyclo[16.4.0]docosa-1(22),18,20-triene is sourced from PubChem (CID 139169771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).