1,3,7,11,15,19,23-heptachlorotetracosane

C24H43Cl7 — CID 22833490

IUPAC1,3,7,11,15,19,23-heptachlorotetracosane
SMILESCC(Cl)CCCC(Cl)CCCC(Cl)CCCC(Cl)CCCC(Cl)CCCC(Cl)CCCl
InChIInChI=1S/C24H43Cl7/c1-19(26)7-2-8-20(27)9-3-10-21(28)11-4-12-22(29)13-5-14-23(30)15-6-16-24(31)17-18-25/h19-24H,2-18H2,1H3
InChIKeyFHKUUILMHIOLID-UHFFFAOYSA-N
MW579.78 g/mol
LogP11.13
Rot. Bonds22

About 1,3,7,11,15,19,23-heptachlorotetracosane

1,3,7,11,15,19,23-heptachlorotetracosane (PubChem CID 22833490) has the molecular formula C24H43Cl7 and a molecular weight of 579.78 g/mol. Its IUPAC name is 1,3,7,11,15,19,23-heptachlorotetracosane.

Molecular Properties

Compound Name1,3,7,11,15,19,23-heptachlorotetracosane
PubChem CID22833490
Molecular FormulaC24H43Cl7
Molecular Weight579.78 g/mol
Exact Mass576.12
IUPAC Name1,3,7,11,15,19,23-heptachlorotetracosane
SMILESCC(Cl)CCCC(Cl)CCCC(Cl)CCCC(Cl)CCCC(Cl)CCCC(Cl)CCCl
InChIInChI=1S/C24H43Cl7/c1-19(26)7-2-8-20(27)9-3-10-21(28)11-4-12-22(29)13-5-14-23(30)15-6-16-24(31)17-18-25/h19-24H,2-18H2,1H3
InChIKeyFHKUUILMHIOLID-UHFFFAOYSA-N
XLogP11.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds22
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500579.78
LogP ≤ 511.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,3,7,11,15,19,23-heptachlorotetracosane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,3,7,11,15,19,23-heptachlorotetracosane?
The IUPAC name of 1,3,7,11,15,19,23-heptachlorotetracosane (CID 22833490) is 1,3,7,11,15,19,23-heptachlorotetracosane.
What is the SMILES notation for 1,3,7,11,15,19,23-heptachlorotetracosane?
The canonical SMILES for 1,3,7,11,15,19,23-heptachlorotetracosane is CC(Cl)CCCC(Cl)CCCC(Cl)CCCC(Cl)CCCC(Cl)CCCC(Cl)CCCl.
What is the InChIKey of 1,3,7,11,15,19,23-heptachlorotetracosane?
The InChIKey is FHKUUILMHIOLID-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H43Cl7/c1-19(26)7-2-8-20(27)9-3-10-21(28)11-4-12-22(29)13-5-14-23(30)15-6-16-24(31)17-18-25/h19-24H,2-18H2,1H3.
What are the key properties of 1,3,7,11,15,19,23-heptachlorotetracosane?
1,3,7,11,15,19,23-heptachlorotetracosane has a molecular weight of 579.78 g/mol, XLogP of 11.13, 22 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,7,11,15,19,23-heptachlorotetracosane is sourced from PubChem (CID 22833490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).