2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane

C36H46O6Si6 — CID 174007704

IUPAC2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane
SMILESC=CC[Si]1(C)O[Si](C)(CC=C)O[Si](C)(C/C=C\c2ccc([Si]3(C=C)O[Si](C=C)(c4ccccc4)O[Si](C=C)(c4ccccc4)O3)cc2)O1
InChIInChI=1S/C36H46O6Si6/c1-9-30-43(6)37-44(7,31-10-2)39-45(8,38-43)32-20-21-33-26-28-36(29-27-33)48(13-5)41-46(11-3,34-22-16-14-17-23-34)40-47(12-4,42-48)35-24-18-15-19-25-35/h9-29H,1-5,30-32H2,6-8H3/b21-20-
InChIKeyZBJBXXAVHMNTOB-MRCUWXFGSA-N
MW743.27 g/mol
LogP6.94
Rot. Bonds13

About 2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane

2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane (PubChem CID 174007704) has the molecular formula C36H46O6Si6 and a molecular weight of 743.27 g/mol. Its IUPAC name is 2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane.

Molecular Properties

Compound Name2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane
PubChem CID174007704
Molecular FormulaC36H46O6Si6
Molecular Weight743.27 g/mol
Exact Mass742.19
IUPAC Name2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane
SMILESC=CC[Si]1(C)O[Si](C)(CC=C)O[Si](C)(C/C=C\c2ccc([Si]3(C=C)O[Si](C=C)(c4ccccc4)O[Si](C=C)(c4ccccc4)O3)cc2)O1
InChIInChI=1S/C36H46O6Si6/c1-9-30-43(6)37-44(7,31-10-2)39-45(8,38-43)32-20-21-33-26-28-36(29-27-33)48(13-5)41-46(11-3,34-22-16-14-17-23-34)40-47(12-4,42-48)35-24-18-15-19-25-35/h9-29H,1-5,30-32H2,6-8H3/b21-20-
InChIKeyZBJBXXAVHMNTOB-MRCUWXFGSA-N
XLogP6.94
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500743.27
LogP ≤ 56.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane with MolForge

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Related Compounds

1,3,7,9-tetraphenyl-5,5,11,11-tetrakis(prop-2-enyl)-2,4,6,8,10,12,13,14-octaoxa-1,3,5,7,9,11-hexasilatricyclo[7.3.1.13,7]tetradecane
CID 177446580
(E)-N-chloro-3-phenyl-N-prop-2-enylprop-2-en-1-amine
CID 121011527
3-bromoprop-1-enylbenzene;prop-1-ene
CID 67394567
[(1E)-5-phenylpenta-1,4-dienyl]benzene
CID 91021368
benzene;but-1-enylbenzene
CID 157481332
[(E)-3-prop-2-enylsulfanylprop-1-enyl]benzene
CID 15189428
2,4,6,8-tetramethyl-2,4,6,8-tetraphenyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 6487
but-1-enylbenzene;but-3-enylbenzene
CID 161099431
hex-1-enylbenzene;prop-1-ene
CID 157442084
1-methyl-4-[4-[(E)-3-phenylprop-1-enyl]phenyl]benzene
CID 144681083
1-phenyl-4-[(1Z,3E)-4-(4-phenylphenyl)buta-1,3-dienyl]benzene
CID 54609084
dimethyl-phenyl-[(Z)-3-phenylprop-2-enyl]silane
CID 102586986

Frequently Asked Questions

What is the IUPAC name of 2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane?
The IUPAC name of 2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane (CID 174007704) is 2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane.
What is the SMILES notation for 2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane?
The canonical SMILES for 2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane is C=CC[Si]1(C)O[Si](C)(CC=C)O[Si](C)(C/C=C\c2ccc([Si]3(C=C)O[Si](C=C)(c4ccccc4)O[Si](C=C)(c4ccccc4)O3)cc2)O1.
What is the InChIKey of 2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane?
The InChIKey is ZBJBXXAVHMNTOB-MRCUWXFGSA-N. The full InChI is InChI=1S/C36H46O6Si6/c1-9-30-43(6)37-44(7,31-10-2)39-45(8,38-43)32-20-21-33-26-28-36(29-27-33)48(13-5)41-46(11-3,34-22-16-14-17-23-34)40-47(12-4,42-48)35-24-18-15-19-25-35/h9-29H,1-5,30-32H2,6-8H3/b21-20-.
What are the key properties of 2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane?
2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane has a molecular weight of 743.27 g/mol, XLogP of 6.94, 13 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-tris(ethenyl)-2,4-diphenyl-6-[4-[(Z)-3-[2,4,6-trimethyl-4,6-bis(prop-2-enyl)-1,3,5,2,4,6-trioxatrisilinan-2-yl]prop-1-enyl]phenyl]-1,3,5,2,4,6-trioxatrisilinane is sourced from PubChem (CID 174007704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).