4,5,6,7-tetraethyldecane

C18H38 — CID 101052128

IUPAC4,5,6,7-tetraethyldecane
SMILESCCCC(CC)C(CC)C(CC)C(CC)CCC
InChIInChI=1S/C18H38/c1-7-13-15(9-3)17(11-5)18(12-6)16(10-4)14-8-2/h15-18H,7-14H2,1-6H3
InChIKeyIZANWDXXDDKSOM-UHFFFAOYSA-N
MW254.50 g/mol
LogP6.69
Rot. Bonds11

About 4,5,6,7-tetraethyldecane

4,5,6,7-tetraethyldecane (PubChem CID 101052128) has the molecular formula C18H38 and a molecular weight of 254.50 g/mol. Its IUPAC name is 4,5,6,7-tetraethyldecane.

Molecular Properties

Compound Name4,5,6,7-tetraethyldecane
PubChem CID101052128
Molecular FormulaC18H38
Molecular Weight254.50 g/mol
Exact Mass254.30
IUPAC Name4,5,6,7-tetraethyldecane
SMILESCCCC(CC)C(CC)C(CC)C(CC)CCC
InChIInChI=1S/C18H38/c1-7-13-15(9-3)17(11-5)18(12-6)16(10-4)14-8-2/h15-18H,7-14H2,1-6H3
InChIKeyIZANWDXXDDKSOM-UHFFFAOYSA-N
XLogP6.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms18
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.50
LogP ≤ 56.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetraethyldecane?
The IUPAC name of 4,5,6,7-tetraethyldecane (CID 101052128) is 4,5,6,7-tetraethyldecane.
What is the SMILES notation for 4,5,6,7-tetraethyldecane?
The canonical SMILES for 4,5,6,7-tetraethyldecane is CCCC(CC)C(CC)C(CC)C(CC)CCC.
What is the InChIKey of 4,5,6,7-tetraethyldecane?
The InChIKey is IZANWDXXDDKSOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38/c1-7-13-15(9-3)17(11-5)18(12-6)16(10-4)14-8-2/h15-18H,7-14H2,1-6H3.
What are the key properties of 4,5,6,7-tetraethyldecane?
4,5,6,7-tetraethyldecane has a molecular weight of 254.50 g/mol, XLogP of 6.69, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetraethyldecane is sourced from PubChem (CID 101052128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).