1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane

C24H40Si4 — CID 11729896

IUPAC1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane
SMILESC[Si]1(C)CCC[Si](C)(c2ccccc2)[Si](C)(C)CCC[Si]1(C)c1ccccc1
InChIInChI=1S/C24H40Si4/c1-25(2)19-13-22-28(6,24-17-11-8-12-18-24)26(3,4)20-14-21-27(25,5)23-15-9-7-10-16-23/h7-12,15-18H,13-14,19-22H2,1-6H3
InChIKeyBTPKEMWJDLBQKC-UHFFFAOYSA-N
MW440.93 g/mol
LogP6.33
Rot. Bonds2

About 1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane

1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane (PubChem CID 11729896) has the molecular formula C24H40Si4 and a molecular weight of 440.93 g/mol. Its IUPAC name is 1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane.

Molecular Properties

Compound Name1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane
PubChem CID11729896
Molecular FormulaC24H40Si4
Molecular Weight440.93 g/mol
Exact Mass440.22
IUPAC Name1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane
SMILESC[Si]1(C)CCC[Si](C)(c2ccccc2)[Si](C)(C)CCC[Si]1(C)c1ccccc1
InChIInChI=1S/C24H40Si4/c1-25(2)19-13-22-28(6,24-17-11-8-12-18-24)26(3,4)20-14-21-27(25,5)23-15-9-7-10-16-23/h7-12,15-18H,13-14,19-22H2,1-6H3
InChIKeyBTPKEMWJDLBQKC-UHFFFAOYSA-N
XLogP6.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.93
LogP ≤ 56.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 86071177
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CID 15499078
1,1-diphenylsilocane
CID 69463623
2-methyl-2-phenyloxasilinane
CID 174568413
4-methyl-4-phenyl-1,4-azasilinane
CID 66925910
N,N-dimethyl-4-(1-phenylsiletan-1-yl)aniline
CID 617479
6-chloro-2,2,3,6-tetramethyl-3-phenyloxadisilinane
CID 67759204
3-methyl-3-phenyldioxasilirane
CID 57317747
2,4,6,8-tetramethyl-2,4,6,8-tetraphenyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 6487
1,1,2,2,3,3,4,4,5-nonamethyl-5-phenylpentasilolane
CID 13004938
2,4,6-trimethyl-2,4,6-triphenyl-1,3,5,2,4,6-trithiatrisilinane
CID 15717312
1-methyl-1-phenoxysiletane
CID 139777846

Frequently Asked Questions

What is the IUPAC name of 1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane?
The IUPAC name of 1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane (CID 11729896) is 1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane.
What is the SMILES notation for 1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane?
The canonical SMILES for 1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane is C[Si]1(C)CCC[Si](C)(c2ccccc2)[Si](C)(C)CCC[Si]1(C)c1ccccc1.
What is the InChIKey of 1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane?
The InChIKey is BTPKEMWJDLBQKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H40Si4/c1-25(2)19-13-22-28(6,24-17-11-8-12-18-24)26(3,4)20-14-21-27(25,5)23-15-9-7-10-16-23/h7-12,15-18H,13-14,19-22H2,1-6H3.
What are the key properties of 1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane?
1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane has a molecular weight of 440.93 g/mol, XLogP of 6.33, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane is sourced from PubChem (CID 11729896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).