About adamantane;adamantane-1,3,5-triol;bicyclo[2.2.1]heptan-1-ol;2-butyladamantane;1-cyclohexylethylcyclohexane;3,5-dimethyladamantan-1-ol;1-hexan-2-yladamantane;3-hexan-2-yladamantan-1-ol;1-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;bis(2-methyladamantane);4-methyladamantan-1-ol;2-methylbicyclo[2.2.1]heptane;methylcyclodecane;methylcyclododecane;methylcycloheptane;8-methyltricyclo[5.2.1.02,6]decane;1-propan-2-yladamantane;3-propan-2-yladamantan-1-ol;4-propan-2-yladamantan-1-ol;propan-2-ylcyclohexane;1,2,7,7-tetramethylbicyclo[2.2.1]heptane;2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecane;2,2,3-trimethylbicyclo[2.2.1]heptane
adamantane;adamantane-1,3,5-triol;bicyclo[2.2.1]heptan-1-ol;2-butyladamantane;1-cyclohexylethylcyclohexane;3,5-dimethyladamantan-1-ol;1-hexan-2-yladamantane;3-hexan-2-yladamantan-1-ol;1-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;bis(2-methyladamantane);4-methyladamantan-1-ol;2-methylbicyclo[2.2.1]heptane;methylcyclodecane;methylcyclododecane;methylcycloheptane;8-methyltricyclo[5.2.1.02,6]decane;1-propan-2-yladamantane;3-propan-2-yladamantan-1-ol;4-propan-2-yladamantan-1-ol;propan-2-ylcyclohexane;1,2,7,7-tetramethylbicyclo[2.2.1]heptane;2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecane;2,2,3-trimethylbicyclo[2.2.1]heptane (PubChem CID 158747852) has the molecular formula C289H508O9
and a molecular weight of 4127.23 g/mol. Its IUPAC name is adamantane;adamantane-1,3,5-triol;bicyclo[2.2.1]heptan-1-ol;2-butyladamantane;1-cyclohexylethylcyclohexane;3,5-dimethyladamantan-1-ol;1-hexan-2-yladamantane;3-hexan-2-yladamantan-1-ol;1-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;bis(2-methyladamantane);4-methyladamantan-1-ol;2-methylbicyclo[2.2.1]heptane;methylcyclodecane;methylcyclododecane;methylcycloheptane;8-methyltricyclo[5.2.1.02,6]decane;1-propan-2-yladamantane;3-propan-2-yladamantan-1-ol;4-propan-2-yladamantan-1-ol;propan-2-ylcyclohexane;1,2,7,7-tetramethylbicyclo[2.2.1]heptane;2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecane;2,2,3-trimethylbicyclo[2.2.1]heptane.
Frequently Asked Questions
What is the IUPAC name of adamantane;adamantane-1,3,5-triol;bicyclo[2.2.1]heptan-1-ol;2-butyladamantane;1-cyclohexylethylcyclohexane;3,5-dimethyladamantan-1-ol;1-hexan-2-yladamantane;3-hexan-2-yladamantan-1-ol;1-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;bis(2-methyladamantane);4-methyladamantan-1-ol;2-methylbicyclo[2.2.1]heptane;methylcyclodecane;methylcyclododecane;methylcycloheptane;8-methyltricyclo[5.2.1.02,6]decane;1-propan-2-yladamantane;3-propan-2-yladamantan-1-ol;4-propan-2-yladamantan-1-ol;propan-2-ylcyclohexane;1,2,7,7-tetramethylbicyclo[2.2.1]heptane;2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecane;2,2,3-trimethylbicyclo[2.2.1]heptane?
The IUPAC name of adamantane;adamantane-1,3,5-triol;bicyclo[2.2.1]heptan-1-ol;2-butyladamantane;1-cyclohexylethylcyclohexane;3,5-dimethyladamantan-1-ol;1-hexan-2-yladamantane;3-hexan-2-yladamantan-1-ol;1-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;bis(2-methyladamantane);4-methyladamantan-1-ol;2-methylbicyclo[2.2.1]heptane;methylcyclodecane;methylcyclododecane;methylcycloheptane;8-methyltricyclo[5.2.1.02,6]decane;1-propan-2-yladamantane;3-propan-2-yladamantan-1-ol;4-propan-2-yladamantan-1-ol;propan-2-ylcyclohexane;1,2,7,7-tetramethylbicyclo[2.2.1]heptane;2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecane;2,2,3-trimethylbicyclo[2.2.1]heptane (CID 158747852) is adamantane;adamantane-1,3,5-triol;bicyclo[2.2.1]heptan-1-ol;2-butyladamantane;1-cyclohexylethylcyclohexane;3,5-dimethyladamantan-1-ol;1-hexan-2-yladamantane;3-hexan-2-yladamantan-1-ol;1-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;bis(2-methyladamantane);4-methyladamantan-1-ol;2-methylbicyclo[2.2.1]heptane;methylcyclodecane;methylcyclododecane;methylcycloheptane;8-methyltricyclo[5.2.1.02,6]decane;1-propan-2-yladamantane;3-propan-2-yladamantan-1-ol;4-propan-2-yladamantan-1-ol;propan-2-ylcyclohexane;1,2,7,7-tetramethylbicyclo[2.2.1]heptane;2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecane;2,2,3-trimethylbicyclo[2.2.1]heptane.
What is the SMILES notation for adamantane;adamantane-1,3,5-triol;bicyclo[2.2.1]heptan-1-ol;2-butyladamantane;1-cyclohexylethylcyclohexane;3,5-dimethyladamantan-1-ol;1-hexan-2-yladamantane;3-hexan-2-yladamantan-1-ol;1-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;bis(2-methyladamantane);4-methyladamantan-1-ol;2-methylbicyclo[2.2.1]heptane;methylcyclodecane;methylcyclododecane;methylcycloheptane;8-methyltricyclo[5.2.1.02,6]decane;1-propan-2-yladamantane;3-propan-2-yladamantan-1-ol;4-propan-2-yladamantan-1-ol;propan-2-ylcyclohexane;1,2,7,7-tetramethylbicyclo[2.2.1]heptane;2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecane;2,2,3-trimethylbicyclo[2.2.1]heptane?
The canonical SMILES for adamantane;adamantane-1,3,5-triol;bicyclo[2.2.1]heptan-1-ol;2-butyladamantane;1-cyclohexylethylcyclohexane;3,5-dimethyladamantan-1-ol;1-hexan-2-yladamantane;3-hexan-2-yladamantan-1-ol;1-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;bis(2-methyladamantane);4-methyladamantan-1-ol;2-methylbicyclo[2.2.1]heptane;methylcyclodecane;methylcyclododecane;methylcycloheptane;8-methyltricyclo[5.2.1.02,6]decane;1-propan-2-yladamantane;3-propan-2-yladamantan-1-ol;4-propan-2-yladamantan-1-ol;propan-2-ylcyclohexane;1,2,7,7-tetramethylbicyclo[2.2.1]heptane;2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecane;2,2,3-trimethylbicyclo[2.2.1]heptane is C1C2CC3CC1CC(C2)C3.CC(C)C12CC3CC(CC(C3)C1)C2.CC(C)C12CC3CC(CC(O)(C3)C1)C2.CC(C)C1C2CC3CC1CC(O)(C3)C2.CC(C)C1CCCCC1.CC(C1CCCCC1)C1CCCCC1.CC12CC3CC(C)(C1)CC(O)(C3)C2.CC1C2CC3CC(C2)CC1C3.CC1C2CC3CC(C2)CC1C3.CC1C2CC3CC1CC(O)(C3)C2.CC1C2CCC(C2)C1(C)C.CC1CC2CC1C1CCCC21.CC1CC2CCC1(C)C2(C)C.CC1CC2CCC1C2.CC1CCC23CC1C(C)(C)C2CCC3C.CC1CCC2CCCCC2C1.CC1CCCC2CCCCC12.CC1CCCCCC1.CC1CCCCCCCCC1.CC1CCCCCCCCCCC1.CCCCC(C)C12CC3CC(CC(C3)C1)C2.CCCCC(C)C12CC3CC(CC(O)(C3)C1)C2.CCCCC1C2CC3CC(C2)CC1C3.OC12CC3CC(O)(C1)CC(O)(C3)C2.OC12CCC(CC1)C2.
What is the InChIKey of adamantane;adamantane-1,3,5-triol;bicyclo[2.2.1]heptan-1-ol;2-butyladamantane;1-cyclohexylethylcyclohexane;3,5-dimethyladamantan-1-ol;1-hexan-2-yladamantane;3-hexan-2-yladamantan-1-ol;1-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;bis(2-methyladamantane);4-methyladamantan-1-ol;2-methylbicyclo[2.2.1]heptane;methylcyclodecane;methylcyclododecane;methylcycloheptane;8-methyltricyclo[5.2.1.02,6]decane;1-propan-2-yladamantane;3-propan-2-yladamantan-1-ol;4-propan-2-yladamantan-1-ol;propan-2-ylcyclohexane;1,2,7,7-tetramethylbicyclo[2.2.1]heptane;2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecane;2,2,3-trimethylbicyclo[2.2.1]heptane?
The InChIKey is INCHKNIVVVRYAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28O.C16H28.C15H26.C14H24.C14H26.2C13H22O.C13H22.C13H26.C12H20O.C11H18O.3C11H18.3C11H20.C11H22.C10H16O3.C10H16.C10H18.C9H18.C8H14.C8H16.C7H12O/c1-3-4-5-12(2)15-7-13-6-14(8-15)10-16(17,9-13)11-15;1-3-4-5-12(2)16-9-13-6-14(10-16)8-15(7-13)11-16;1-10-7-8-15-9-12(10)14(3,4)13(15)6-5-11(15)2;1-2-3-4-14-12-6-10-5-11(8-12)9-13(14)7-10;1-12(13-8-4-2-5-9-13)14-10-6-3-7-11-14;1-9(2)12-4-10-3-11(5-12)7-13(14,6-10)8-12;1-8(2)12-10-3-9-4-11(12)7-13(14,5-9)6-10;1-9(2)13-6-10-3-11(7-13)5-12(4-10)8-13;1-13-11-9-7-5-3-2-4-6-8-10-12-13;1-10-3-9-4-11(2,6-10)8-12(13,5-9)7-10;1-7-9-2-8-3-10(7)6-11(12,4-8)5-9;2*1-7-10-3-8-2-9(5-10)6-11(7)4-8;1-7-5-8-6-11(7)10-4-2-3-9(8)10;1-8-7-9-5-6-11(8,4)10(9,2)3;1-9-5-4-7-10-6-2-3-8-11(9)10;1-9-6-7-10-4-2-3-5-11(10)8-9;1-11-9-7-5-3-2-4-6-8-10-11;11-8-1-7-2-9(12,4-8)6-10(13,3-7)5-8;1-7-2-9-4-8(1)5-10(3-7)6-9;1-7-8-4-5-9(6-8)10(7,2)3;1-8(2)9-6-4-3-5-7-9;1-6-4-7-2-3-8(6)5-7;1-8-6-4-2-3-5-7-8;8-7-3-1-6(5-7)2-4-7/h12-14,17H,3-11H2,1-2H3;12-15H,3-11H2,1-2H3;10-13H,5-9H2,1-4H3;10-14H,2-9H2,1H3;12-14H,2-11H2,1H3;9-11,14H,3-8H2,1-2H3;8-12,14H,3-7H2,1-2H3;9-12H,3-8H2,1-2H3;13H,2-12H2,1H3;9,13H,3-8H2,1-2H3;7-10,12H,2-6H2,1H3;3*7-11H,2-6H2,1H3;8-9H,5-7H2,1-4H3;2*9-11H,2-8H2,1H3;11H,2-10H2,1H3;7,11-13H,1-6H2;7-10H,1-6H2;7-9H,4-6H2,1-3H3;8-9H,3-7H2,1-2H3;6-8H,2-5H2,1H3;8H,2-7H2,1H3;6,8H,1-5H2.
What are the key properties of adamantane;adamantane-1,3,5-triol;bicyclo[2.2.1]heptan-1-ol;2-butyladamantane;1-cyclohexylethylcyclohexane;3,5-dimethyladamantan-1-ol;1-hexan-2-yladamantane;3-hexan-2-yladamantan-1-ol;1-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;bis(2-methyladamantane);4-methyladamantan-1-ol;2-methylbicyclo[2.2.1]heptane;methylcyclodecane;methylcyclododecane;methylcycloheptane;8-methyltricyclo[5.2.1.02,6]decane;1-propan-2-yladamantane;3-propan-2-yladamantan-1-ol;4-propan-2-yladamantan-1-ol;propan-2-ylcyclohexane;1,2,7,7-tetramethylbicyclo[2.2.1]heptane;2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecane;2,2,3-trimethylbicyclo[2.2.1]heptane?
adamantane;adamantane-1,3,5-triol;bicyclo[2.2.1]heptan-1-ol;2-butyladamantane;1-cyclohexylethylcyclohexane;3,5-dimethyladamantan-1-ol;1-hexan-2-yladamantane;3-hexan-2-yladamantan-1-ol;1-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;bis(2-methyladamantane);4-methyladamantan-1-ol;2-methylbicyclo[2.2.1]heptane;methylcyclodecane;methylcyclododecane;methylcycloheptane;8-methyltricyclo[5.2.1.02,6]decane;1-propan-2-yladamantane;3-propan-2-yladamantan-1-ol;4-propan-2-yladamantan-1-ol;propan-2-ylcyclohexane;1,2,7,7-tetramethylbicyclo[2.2.1]heptane;2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecane;2,2,3-trimethylbicyclo[2.2.1]heptane has a molecular weight of 4127.23 g/mol, XLogP of 82.33, 17 rotatable bonds, 9 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for adamantane;adamantane-1,3,5-triol;bicyclo[2.2.1]heptan-1-ol;2-butyladamantane;1-cyclohexylethylcyclohexane;3,5-dimethyladamantan-1-ol;1-hexan-2-yladamantane;3-hexan-2-yladamantan-1-ol;1-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;bis(2-methyladamantane);4-methyladamantan-1-ol;2-methylbicyclo[2.2.1]heptane;methylcyclodecane;methylcyclododecane;methylcycloheptane;8-methyltricyclo[5.2.1.02,6]decane;1-propan-2-yladamantane;3-propan-2-yladamantan-1-ol;4-propan-2-yladamantan-1-ol;propan-2-ylcyclohexane;1,2,7,7-tetramethylbicyclo[2.2.1]heptane;2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecane;2,2,3-trimethylbicyclo[2.2.1]heptane is sourced from PubChem (CID 158747852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).