octane

Synonyms: "n-octane".

Source: Octane is used in organic syntheses, calibrations, and azeotropic distillations and is a common component of gasoline and other petroleum products.

Identifiers:

IUPAC Name: octane
CAS Number: 111-65-9
PubChem ID: 356
InChiKey: TVMXDCGIABBOFY-UHFFFAOYSA-N
Canonical SMILES: CCCCCCCC

Structural Properties:

Molecular Formula: C₈H₁₈
Molecular Weight: 114.232

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 0
Number of atoms different from hydrogen: 8

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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors

Khan S, Mukhtar H, Pandya KP. 1980. n-Octane and n-nonane induced alterations in xenobiotic metabolising enzyme activities and lipid peroxidation of rat liver. Toxicology 16(3):239-245. DOI: 10.1016/0300-483X(80)90120-1. URL: https://www.sciencedirect.com/science/article/pii/0300483X80901201.