2,4-dihexyl-1,1-dimethylsilole

C18H34Si — CID 102088905

IUPAC2,4-dihexyl-1,1-dimethylsilole
SMILESCCCCCCC1=C[Si](C)(C)C(CCCCCC)=C1
InChIInChI=1S/C18H34Si/c1-5-7-9-11-13-17-15-18(19(3,4)16-17)14-12-10-8-6-2/h15-16H,5-14H2,1-4H3
InChIKeyMMHVABVVJZOJBP-UHFFFAOYSA-N
MW278.56 g/mol
LogP6.58
Rot. Bonds10

About 2,4-dihexyl-1,1-dimethylsilole

2,4-dihexyl-1,1-dimethylsilole (PubChem CID 102088905) has the molecular formula C18H34Si and a molecular weight of 278.56 g/mol. Its IUPAC name is 2,4-dihexyl-1,1-dimethylsilole.

Molecular Properties

Compound Name2,4-dihexyl-1,1-dimethylsilole
PubChem CID102088905
Molecular FormulaC18H34Si
Molecular Weight278.56 g/mol
Exact Mass278.24
IUPAC Name2,4-dihexyl-1,1-dimethylsilole
SMILESCCCCCCC1=C[Si](C)(C)C(CCCCCC)=C1
InChIInChI=1S/C18H34Si/c1-5-7-9-11-13-17-15-18(19(3,4)16-17)14-12-10-8-6-2/h15-16H,5-14H2,1-4H3
InChIKeyMMHVABVVJZOJBP-UHFFFAOYSA-N
XLogP6.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.56
LogP ≤ 56.58
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

[(E)-2-(cyclohexen-1-yl)ethenyl]-trimethylsilane
CID 14175461
[(E)-2-(cyclopenten-1-yl)ethenyl]-trimethylsilane
CID 14175462
[(E)-3-butyl-2-methyl-5-methylidenenon-2-enyl]-triethylsilane
CID 101777994
2-(Cyclopenten-1-yl)ethyl-trimethylsilane
CID 139263552
trimethyl-[(2E)-5-pentyldeca-2,4-dienyl]silane
CID 11196759
[(1Z,3Z)-2-hexyl-1,4-diiododeca-1,3-dienyl]-trimethylsilane
CID 11261306
1,1-Dimethyl-2,3,4,5-tetrapropylsilacyclopenta-2,4-diene
CID 12190885
trimethyl-[(E)-3-methylnon-2-enyl]silane
CID 12507241
3,4-Dihexyl-1,1-dimethylsilole
CID 14960758
[(1E)-1-[(2E)-2-hexylidenecyclohexylidene]but-3-enyl]-trimethylsilane
CID 15362815
1,2,4-Trihexyl-5-methylidenecyclopenta-1,3-diene
CID 15482197
Trimethyl-[2-(trimethylsilylmethyl)dodec-2-enyl]silane
CID 16046668

Frequently Asked Questions

What is the IUPAC name of 2,4-dihexyl-1,1-dimethylsilole?
The IUPAC name of 2,4-dihexyl-1,1-dimethylsilole (CID 102088905) is 2,4-dihexyl-1,1-dimethylsilole.
What is the SMILES notation for 2,4-dihexyl-1,1-dimethylsilole?
The canonical SMILES for 2,4-dihexyl-1,1-dimethylsilole is CCCCCCC1=C[Si](C)(C)C(CCCCCC)=C1.
What is the InChIKey of 2,4-dihexyl-1,1-dimethylsilole?
The InChIKey is MMHVABVVJZOJBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34Si/c1-5-7-9-11-13-17-15-18(19(3,4)16-17)14-12-10-8-6-2/h15-16H,5-14H2,1-4H3.
What are the key properties of 2,4-dihexyl-1,1-dimethylsilole?
2,4-dihexyl-1,1-dimethylsilole has a molecular weight of 278.56 g/mol, XLogP of 6.58, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dihexyl-1,1-dimethylsilole is sourced from PubChem (CID 102088905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).