8-pentyl-6,10-dipropylpentadecane

C26H54 — CID 58892246

IUPAC8-pentyl-6,10-dipropylpentadecane
SMILESCCCCCC(CCC)CC(CCCCC)CC(CCC)CCCCC
InChIInChI=1S/C26H54/c1-6-11-14-19-24(17-9-4)22-26(21-16-13-8-3)23-25(18-10-5)20-15-12-7-2/h24-26H,6-23H2,1-5H3
InChIKeyCUMOHXRGLMHWCS-UHFFFAOYSA-N
MW366.72 g/mol
LogP9.96
Rot. Bonds20

About 8-pentyl-6,10-dipropylpentadecane

8-pentyl-6,10-dipropylpentadecane (PubChem CID 58892246) has the molecular formula C26H54 and a molecular weight of 366.72 g/mol. Its IUPAC name is 8-pentyl-6,10-dipropylpentadecane.

Molecular Properties

Compound Name8-pentyl-6,10-dipropylpentadecane
PubChem CID58892246
Molecular FormulaC26H54
Molecular Weight366.72 g/mol
Exact Mass366.42
IUPAC Name8-pentyl-6,10-dipropylpentadecane
SMILESCCCCCC(CCC)CC(CCCCC)CC(CCC)CCCCC
InChIInChI=1S/C26H54/c1-6-11-14-19-24(17-9-4)22-26(21-16-13-8-3)23-25(18-10-5)20-15-12-7-2/h24-26H,6-23H2,1-5H3
InChIKeyCUMOHXRGLMHWCS-UHFFFAOYSA-N
XLogP9.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds20
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.72
LogP ≤ 59.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

7,9-dipropylhexadecane
CID 91047634
8-heptyl-10-propyloctadecane
CID 90802423
9-hexyl-7-propylheptadecane
CID 91243882
9-butyl-7-propylheptadecane
CID 91567761
7-butyl-9-propylhexadecane
CID 91502397
6-butyl-4,8-dipropylundecane
CID 158410657
9-heptyl-11-octylnonadecane
CID 91326024
11,13-didecyltricosane
CID 91473894
4-ethyl-6-propyltridecane
CID 90859634
8-ethyl-10-propyloctadecane
CID 91006189
4-ethyl-6-propyltetradecane
CID 91553020
5,7-dibutyltridecane
CID 14297331

Frequently Asked Questions

What is the IUPAC name of 8-pentyl-6,10-dipropylpentadecane?
The IUPAC name of 8-pentyl-6,10-dipropylpentadecane (CID 58892246) is 8-pentyl-6,10-dipropylpentadecane.
What is the SMILES notation for 8-pentyl-6,10-dipropylpentadecane?
The canonical SMILES for 8-pentyl-6,10-dipropylpentadecane is CCCCCC(CCC)CC(CCCCC)CC(CCC)CCCCC.
What is the InChIKey of 8-pentyl-6,10-dipropylpentadecane?
The InChIKey is CUMOHXRGLMHWCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H54/c1-6-11-14-19-24(17-9-4)22-26(21-16-13-8-3)23-25(18-10-5)20-15-12-7-2/h24-26H,6-23H2,1-5H3.
What are the key properties of 8-pentyl-6,10-dipropylpentadecane?
8-pentyl-6,10-dipropylpentadecane has a molecular weight of 366.72 g/mol, XLogP of 9.96, 20 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-pentyl-6,10-dipropylpentadecane is sourced from PubChem (CID 58892246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).