(2-ethenyl-4,6-dihexylphenyl)-trimethylsilane

C23H40Si — CID 11325397

IUPAC(2-ethenyl-4,6-dihexylphenyl)-trimethylsilane
SMILESC=Cc1cc(CCCCCC)cc(CCCCCC)c1[Si](C)(C)C
InChIInChI=1S/C23H40Si/c1-7-10-12-14-16-20-18-21(9-3)23(24(4,5)6)22(19-20)17-15-13-11-8-2/h9,18-19H,3,7-8,10-17H2,1-2,4-6H3
InChIKeyZARIUJLXXICRMN-UHFFFAOYSA-N
MW344.66 g/mol
LogP7.12
Rot. Bonds12

About (2-ethenyl-4,6-dihexylphenyl)-trimethylsilane

(2-ethenyl-4,6-dihexylphenyl)-trimethylsilane (PubChem CID 11325397) has the molecular formula C23H40Si and a molecular weight of 344.66 g/mol. Its IUPAC name is (2-ethenyl-4,6-dihexylphenyl)-trimethylsilane.

Molecular Properties

Compound Name(2-ethenyl-4,6-dihexylphenyl)-trimethylsilane
PubChem CID11325397
Molecular FormulaC23H40Si
Molecular Weight344.66 g/mol
Exact Mass344.29
IUPAC Name(2-ethenyl-4,6-dihexylphenyl)-trimethylsilane
SMILESC=Cc1cc(CCCCCC)cc(CCCCCC)c1[Si](C)(C)C
InChIInChI=1S/C23H40Si/c1-7-10-12-14-16-20-18-21(9-3)23(24(4,5)6)22(19-20)17-15-13-11-8-2/h9,18-19H,3,7-8,10-17H2,1-2,4-6H3
InChIKeyZARIUJLXXICRMN-UHFFFAOYSA-N
XLogP7.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.66
LogP ≤ 57.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1,3,5-tris-decyl-2-ethenylbenzene
CID 152557926
1,4-dibutyl-2-ethenylbenzene
CID 140596757
(2,6-difluoro-4-pentylphenyl)-trimethylsilane
CID 15751979
1-dodecyl-4-ethenyl-2,5-diethylbenzene
CID 142098538
5-butyl-1,2,3-tridodecylbenzene
CID 91450595
2,4,6-triheptylphenol
CID 139692303
(3,5-dioctylphenyl)-trimethylsilane
CID 156630407
3-ethenyl-2,8-dioctyldibenzofuran
CID 68687499
4-butyl-2,6-didodecylphenol
CID 66619638
1,2-bis(ethenyl)benzene;hexylbenzene
CID 175593213
3-dodecyl-4-ethenylpyridine
CID 23503907
1-butyl-3,5-di(tetradecyl)benzene
CID 91192270

Frequently Asked Questions

What is the IUPAC name of (2-ethenyl-4,6-dihexylphenyl)-trimethylsilane?
The IUPAC name of (2-ethenyl-4,6-dihexylphenyl)-trimethylsilane (CID 11325397) is (2-ethenyl-4,6-dihexylphenyl)-trimethylsilane.
What is the SMILES notation for (2-ethenyl-4,6-dihexylphenyl)-trimethylsilane?
The canonical SMILES for (2-ethenyl-4,6-dihexylphenyl)-trimethylsilane is C=Cc1cc(CCCCCC)cc(CCCCCC)c1[Si](C)(C)C.
What is the InChIKey of (2-ethenyl-4,6-dihexylphenyl)-trimethylsilane?
The InChIKey is ZARIUJLXXICRMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H40Si/c1-7-10-12-14-16-20-18-21(9-3)23(24(4,5)6)22(19-20)17-15-13-11-8-2/h9,18-19H,3,7-8,10-17H2,1-2,4-6H3.
What are the key properties of (2-ethenyl-4,6-dihexylphenyl)-trimethylsilane?
(2-ethenyl-4,6-dihexylphenyl)-trimethylsilane has a molecular weight of 344.66 g/mol, XLogP of 7.12, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethenyl-4,6-dihexylphenyl)-trimethylsilane is sourced from PubChem (CID 11325397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).