2,6,10,14,19,23-hexamethylhexacosane

C32H66 — CID 6428620

IUPAC2,6,10,14,19,23-hexamethylhexacosane
SMILESCCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)CCCC(C)C
InChIInChI=1S/C32H66/c1-9-16-28(4)21-13-22-29(5)18-10-11-19-30(6)23-14-25-32(8)26-15-24-31(7)20-12-17-27(2)3/h27-32H,9-26H2,1-8H3
InChIKeyZEPYTFPGKAZHKE-UHFFFAOYSA-N
MW450.88 g/mol
LogP11.86
Rot. Bonds23

About 2,6,10,14,19,23-hexamethylhexacosane

2,6,10,14,19,23-hexamethylhexacosane (PubChem CID 6428620) has the molecular formula C32H66 and a molecular weight of 450.88 g/mol. Its IUPAC name is 2,6,10,14,19,23-hexamethylhexacosane.

Molecular Properties

Compound Name2,6,10,14,19,23-hexamethylhexacosane
PubChem CID6428620
Molecular FormulaC32H66
Molecular Weight450.88 g/mol
Exact Mass450.52
IUPAC Name2,6,10,14,19,23-hexamethylhexacosane
SMILESCCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)CCCC(C)C
InChIInChI=1S/C32H66/c1-9-16-28(4)21-13-22-29(5)18-10-11-19-30(6)23-14-25-32(8)26-15-24-31(7)20-12-17-27(2)3/h27-32H,9-26H2,1-8H3
InChIKeyZEPYTFPGKAZHKE-UHFFFAOYSA-N
XLogP11.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds23
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500450.88
LogP ≤ 511.86
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

2,9,13-trimethylhexadecane
CID 123827297
2,6-dimethylundecane
CID 28453
2,6,10,14,19-pentamethyltetracosane
CID 6428632
2-methyloctane;4-methyloctane;nonane
CID 160563952
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
2,6,10,15,19-pentamethylhenicosane
CID 6428617
4,8,14-trimethyltetratriacontane
CID 6431076
2,44-dimethyltripentacontane
CID 123367078

Frequently Asked Questions

What is the IUPAC name of 2,6,10,14,19,23-hexamethylhexacosane?
The IUPAC name of 2,6,10,14,19,23-hexamethylhexacosane (CID 6428620) is 2,6,10,14,19,23-hexamethylhexacosane.
What is the SMILES notation for 2,6,10,14,19,23-hexamethylhexacosane?
The canonical SMILES for 2,6,10,14,19,23-hexamethylhexacosane is CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)CCCC(C)C.
What is the InChIKey of 2,6,10,14,19,23-hexamethylhexacosane?
The InChIKey is ZEPYTFPGKAZHKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H66/c1-9-16-28(4)21-13-22-29(5)18-10-11-19-30(6)23-14-25-32(8)26-15-24-31(7)20-12-17-27(2)3/h27-32H,9-26H2,1-8H3.
What are the key properties of 2,6,10,14,19,23-hexamethylhexacosane?
2,6,10,14,19,23-hexamethylhexacosane has a molecular weight of 450.88 g/mol, XLogP of 11.86, 23 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,10,14,19,23-hexamethylhexacosane is sourced from PubChem (CID 6428620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).