2,6,10,14,19-pentamethyltetracosane

C29H60 — CID 6428632

IUPAC2,6,10,14,19-pentamethyltetracosane
SMILESCCCCCC(C)CCCCC(C)CCCC(C)CCCC(C)CCCC(C)C
InChIInChI=1S/C29H60/c1-8-9-10-17-26(4)18-11-12-19-27(5)21-14-23-29(7)24-15-22-28(6)20-13-16-25(2)3/h25-29H,8-24H2,1-7H3
InChIKeyYCDUQPPJIYTIJD-UHFFFAOYSA-N
MW408.80 g/mol
LogP10.84
Rot. Bonds21

About 2,6,10,14,19-pentamethyltetracosane

2,6,10,14,19-pentamethyltetracosane (PubChem CID 6428632) has the molecular formula C29H60 and a molecular weight of 408.80 g/mol. Its IUPAC name is 2,6,10,14,19-pentamethyltetracosane.

Molecular Properties

Compound Name2,6,10,14,19-pentamethyltetracosane
PubChem CID6428632
Molecular FormulaC29H60
Molecular Weight408.80 g/mol
Exact Mass408.47
IUPAC Name2,6,10,14,19-pentamethyltetracosane
SMILESCCCCCC(C)CCCCC(C)CCCC(C)CCCC(C)CCCC(C)C
InChIInChI=1S/C29H60/c1-8-9-10-17-26(4)18-11-12-19-27(5)21-14-23-29(7)24-15-22-28(6)20-13-16-25(2)3/h25-29H,8-24H2,1-7H3
InChIKeyYCDUQPPJIYTIJD-UHFFFAOYSA-N
XLogP10.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds21
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.80
LogP ≤ 510.84
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

2,6-dimethylundecane
CID 28453
2,6-dimethylicosane
CID 54262109
2,6-dimethyltriacontane
CID 526581
2,6,10-trimethyldocosane
CID 175986851
2,6-dimethyltridecane
CID 524061
2,8-dimethylhexacosane
CID 91748840
2,44-dimethyltripentacontane
CID 123367078
2,10,16-trimethyloctacosane
CID 91748811
2,15,18-trimethylhentriacontane
CID 90944921
2,6,10,14,19,23-hexamethylhexacosane
CID 6428620
7,11-dimethylpentatriacontane
CID 6430674
11,15-dimethyloctacosane
CID 71367376

Frequently Asked Questions

What is the IUPAC name of 2,6,10,14,19-pentamethyltetracosane?
The IUPAC name of 2,6,10,14,19-pentamethyltetracosane (CID 6428632) is 2,6,10,14,19-pentamethyltetracosane.
What is the SMILES notation for 2,6,10,14,19-pentamethyltetracosane?
The canonical SMILES for 2,6,10,14,19-pentamethyltetracosane is CCCCCC(C)CCCCC(C)CCCC(C)CCCC(C)CCCC(C)C.
What is the InChIKey of 2,6,10,14,19-pentamethyltetracosane?
The InChIKey is YCDUQPPJIYTIJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H60/c1-8-9-10-17-26(4)18-11-12-19-27(5)21-14-23-29(7)24-15-22-28(6)20-13-16-25(2)3/h25-29H,8-24H2,1-7H3.
What are the key properties of 2,6,10,14,19-pentamethyltetracosane?
2,6,10,14,19-pentamethyltetracosane has a molecular weight of 408.80 g/mol, XLogP of 10.84, 21 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,10,14,19-pentamethyltetracosane is sourced from PubChem (CID 6428632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).