n-hexane
								Synonyms: "hexane", "esani", "gettysolve-B", "hexanes", "hexyl hydride", "skellysolve B", "dipropyl", "hexan"
								Source: hexane is used to extract edible oils from seeds and vegetables, as a special-use solvent, and as a cleaning agent.
							
Identifiers:
								IUPAC Name: hexane
								CAS Number: 110-54-3
								PubChem ID: 8058
								InChiKey: VLKZOEOYAKHREP-UHFFFAOYSA-N
								Canonical SMILES: CCCCCC
							
Structural Properties:
								Molecular Formula: C6H14
								Molecular Weight: 86.175
								
							
Pharmacophore Features:
								Number of bond donors: 0
								Number of bond acceptors: 0
								Number of atoms different from hydrogen: 6
							
Downloads
								2D structure (.sdf)
								
								
								3D structure (.sdf)
								
								
								3D structure (.mol2)
								
								
								3D structure (.pdb)
								
								3D structure (.pdbqt)
								
							
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									Evidence Supporting This Chemical as an Endocrine Disruptor
									
TEDX List of Potential Endocrine Disruptors 
									
								
									Nylé,n P, Ebendal T, Eriksdotter-Nilsson M, Hansson T, Henschen A, Johnson AC, Kronevi T, Kvist U, Sjö,strand NO, Hö,glund G, Olson L. 1989. Testicular atrophy and loss of nerve growth factor-immunoreactive germ cell line in rats exposed to n-hexane and a protective effect of simultaneous exposure to toluene or xylene. Arch Toxicol 63(4):296-307.
External Links
 
 
						2D-structure
								
								3D-structure
										
										
							


