1.0 2026-09-21 18:11:15 UTC 2026-09-21 18:11:15 UTC FDB116871 PMH cpd 2,2,4,6,6-pentamethylheptane C12H26 170.34 170.203450837 2,2,4,6,6-pentamethylheptane 2,2,4,6,6-pentamethylheptane CC(CC(C)(C)C)CC(C)(C)C InChI=1S/C12H26/c1-10(8-11(2,3)4)9-12(5,6)7/h10H,8-9H2,1-7H3 VKPSKYDESGTTFR-UHFFFAOYSA-N belongs to the class of organic compounds known as branched alkanes. These are acyclic branched hydrocarbons having the general formula CnH2n+2. Branched alkanes Organic compounds Hydrocarbons Saturated hydrocarbons Alkanes Aliphatic acyclic compounds Aliphatic acyclic compound Branched alkane alkane logp 6.12 ALOGPS logs -5.21 ALOGPS solubility 1.06e-03 g/l ALOGPS logp 5.04 ChemAxon iupac 2,2,4,6,6-pentamethylheptane ChemAxon average_mass 170.34 ChemAxon mono_mass 170.203450837 ChemAxon smiles CC(CC(C)(C)C)CC(C)(C)C ChemAxon formula C12H26 ChemAxon inchi InChI=1S/C12H26/c1-10(8-11(2,3)4)9-12(5,6)7/h10H,8-9H2,1-7H3 ChemAxon inchikey VKPSKYDESGTTFR-UHFFFAOYSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 56.61 ChemAxon polarizability 23.22 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 104283 Specdb::MsMs 104284 Specdb::MsMs 104285 Specdb::MsMs 170523 Specdb::MsMs 170524 Specdb::MsMs 170525