6-O-[(3R)-hexan-3-yl] 1-O-[(3R)-3-methylpentyl] hexanedioate structure

6-O-[(3R)-hexan-3-yl] 1-O-[(3R)-3-methylpentyl] hexanedioate

6-O-[(3R)-hexan-3-yl] 1-O-[(3R)-3-methylpentyl] hexanedioate

Also Known As: EINECS 289-096-5|Hexanedioic acid, di-C6-10-branched and linear alkyl esters|6-O-[(3R)-hexan-3-yl] 1-O-[(3R)-3-methylpentyl] hexanedioate

CAS: 85995-87-5
Molecular Formula C18H34O4
Molecular Weight 314.2457 g/mol
LogP 4.6481
Topological Polar Surface Area 52.6 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 13
Exact Mass 314.2457
Monoisotopic Mass 314.2457
Heavy Atoms 22
Complexity 301.46228

Chemical Identifiers

CAS Number 85995-87-5
SMILES CCC[C@@H](CC)OC(=O)CCCCC(=O)OCC[C@H](C)CC

Product Overview

6-O-[(3R)-hexan-3-yl] 1-O-[(3R)-3-methylpentyl] hexanedioate (CAS 85995-87-5), with molecular formula C18H34O4 and molecular weight 314.2457 g/mol. IUPAC: 6-O-[(3R)-hexan-3-yl] 1-O-[(3R)-3-methylpentyl] hexanedioate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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6-O-[(3R)-hexan-3-yl] 1-O-[(3R)-3-methylpentyl] hexanedioate is a custom synthesis product. We offer services from milligram to kilogram scale.

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