2-(1-adamantyl)hexan-2-yl prop-2-enoate;2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(1-adamantyl)propan-2-yl prop-2-enoate;(2-butyl-2-adamantyl) 2-methylprop-2-enoate;tert-butyl 2-methylprop-2-enoate;tert-butyl prop-2-enoate;2,3-dimethylbutan-2-yl prop-2-enoate;(1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate;(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl) 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate

C148H236O22 — CID 160653878

About 2-(1-adamantyl)hexan-2-yl prop-2-enoate;2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(1-adamantyl)propan-2-yl prop-2-enoate;(2-butyl-2-adamantyl) 2-methylprop-2-enoate;tert-butyl 2-methylprop-2-enoate;tert-butyl prop-2-enoate;2,3-dimethylbutan-2-yl prop-2-enoate;(1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate;(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl) 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate

2-(1-adamantyl)hexan-2-yl prop-2-enoate;2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(1-adamantyl)propan-2-yl prop-2-enoate;(2-butyl-2-adamantyl) 2-methylprop-2-enoate;tert-butyl 2-methylprop-2-enoate;tert-butyl prop-2-enoate;2,3-dimethylbutan-2-yl prop-2-enoate;(1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate;(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl) 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate (PubChem CID 160653878) has the molecular formula C148H236O22 and a molecular weight of 2367.49 g/mol. Its IUPAC name is 2-(1-adamantyl)hexan-2-yl prop-2-enoate;2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(1-adamantyl)propan-2-yl prop-2-enoate;(2-butyl-2-adamantyl) 2-methylprop-2-enoate;tert-butyl 2-methylprop-2-enoate;tert-butyl prop-2-enoate;2,3-dimethylbutan-2-yl prop-2-enoate;(1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate;(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl) 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate.

Molecular Properties

• Compound Name: 2-(1-adamantyl)hexan-2-yl prop-2-enoate;2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(1-adamantyl)propan-2-yl prop-2-enoate;(2-butyl-2-adamantyl) 2-methylprop-2-enoate;tert-butyl 2-methylprop-2-enoate;tert-butyl prop-2-enoate;2,3-dimethylbutan-2-yl prop-2-enoate;(1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate;(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl) 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate
• PubChem CID: 160653878
• Molecular Formula: C148H236O22
• Molecular Weight: 2367.49 g/mol
• Exact Mass: 2365.73
• IUPAC Name: 2-(1-adamantyl)hexan-2-yl prop-2-enoate;2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(1-adamantyl)propan-2-yl prop-2-enoate;(2-butyl-2-adamantyl) 2-methylprop-2-enoate;tert-butyl 2-methylprop-2-enoate;tert-butyl prop-2-enoate;2,3-dimethylbutan-2-yl prop-2-enoate;(1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate;(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl) 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate
• SMILES: C=C(C)C(=O)OC(C)(C)C.C=C(C)C(=O)OC(C)(C)C12CC3CC(CC(C3)C1)C2.C=C(C)C(=O)OC(C)(C)CC.C=C(C)C(=O)OC1(C)C2CC3CC(C2)CC1C3.C=C(C)C(=O)OC1(C)CCC2CCCCC2C1.C=C(C)C(=O)OC1(C)CCCC2CCCCC21.C=C(C)C(=O)OC1(CCCC)C2CC3CC(C2)CC1C3.C=CC(=O)OC(C)(C)C.C=CC(=O)OC(C)(C)C(C)C.C=CC(=O)OC(C)(C)C12CC3CC(CC(C3)C1)C2.C=CC(=O)OC(C)(CCCC)C12CC3CC(CC(C3)C1)C2
• InChI: InChI=1S/C19H30O2.C18H28O2.C17H26O2.C16H24O2.C15H22O2.2C15H24O2.2C9H16O2.C8H14O2.C7H12O2/c1-4-6-7-18(3,21-17(20)5-2)19-11-14-8-15(12-19)10-16(9-14)13-19;1-4-5-6-18(20-17(19)12(2)3)15-8-13-7-14(10-15)11-16(18)9-13;1-11(2)15(18)19-16(3,4)17-8-12-5-13(9-17)7-14(6-12)10-17;1-4-14(17)18-15(2,3)16-8-11-5-12(9-16)7-13(6-11)10-16;1-9(2)14(16)17-15(3)12-5-10-4-11(7-12)8-13(15)6-10;1-11(2)14(16)17-15(3)10-6-8-12-7-4-5-9-13(12)15;1-11(2)14(16)17-15(3)9-8-12-6-4-5-7-13(12)10-15;1-6-9(4,5)11-8(10)7(2)3;1-6-8(10)11-9(4,5)7(2)3;1-6(2)7(9)10-8(3,4)5;1-5-6(8)9-7(2,3)4/h5,14-16H,2,4,6-13H2,1,3H3;13-16H,2,4-11H2,1,3H3;12-14H,1,5-10H2,2-4H3;4,11-13H,1,5-10H2,2-3H3;10-13H,1,4-8H2,2-3H3;2*12-13H,1,4-10H2,2-3H3;2,6H2,1,3-5H3;6-7H,1H2,2-5H3;1H2,2-5H3;5H,1H2,2-4H3
• InChIKey: RKUCKKLMGAEOSK-UHFFFAOYSA-N
• XLogP: 36.08
• TPSA: 289.30 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 31
• Heavy Atoms: 170
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2367.49
LogP ≤ 5	36.08
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(1-adamantyl)hexan-2-yl prop-2-enoate;2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(1-adamantyl)propan-2-yl prop-2-enoate;(2-butyl-2-adamantyl) 2-methylprop-2-enoate;tert-butyl 2-methylprop-2-enoate;tert-butyl prop-2-enoate;2,3-dimethylbutan-2-yl prop-2-enoate;(1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate;(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl) 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate?

The IUPAC name of 2-(1-adamantyl)hexan-2-yl prop-2-enoate;2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(1-adamantyl)propan-2-yl prop-2-enoate;(2-butyl-2-adamantyl) 2-methylprop-2-enoate;tert-butyl 2-methylprop-2-enoate;tert-butyl prop-2-enoate;2,3-dimethylbutan-2-yl prop-2-enoate;(1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate;(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl) 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate (CID 160653878) is 2-(1-adamantyl)hexan-2-yl prop-2-enoate;2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(1-adamantyl)propan-2-yl prop-2-enoate;(2-butyl-2-adamantyl) 2-methylprop-2-enoate;tert-butyl 2-methylprop-2-enoate;tert-butyl prop-2-enoate;2,3-dimethylbutan-2-yl prop-2-enoate;(1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate;(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl) 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate.

What is the SMILES notation for 2-(1-adamantyl)hexan-2-yl prop-2-enoate;2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(1-adamantyl)propan-2-yl prop-2-enoate;(2-butyl-2-adamantyl) 2-methylprop-2-enoate;tert-butyl 2-methylprop-2-enoate;tert-butyl prop-2-enoate;2,3-dimethylbutan-2-yl prop-2-enoate;(1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate;(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl) 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate?

The canonical SMILES for 2-(1-adamantyl)hexan-2-yl prop-2-enoate;2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(1-adamantyl)propan-2-yl prop-2-enoate;(2-butyl-2-adamantyl) 2-methylprop-2-enoate;tert-butyl 2-methylprop-2-enoate;tert-butyl prop-2-enoate;2,3-dimethylbutan-2-yl prop-2-enoate;(1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate;(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl) 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate is C=C(C)C(=O)OC(C)(C)C.C=C(C)C(=O)OC(C)(C)C12CC3CC(CC(C3)C1)C2.C=C(C)C(=O)OC(C)(C)CC.C=C(C)C(=O)OC1(C)C2CC3CC(C2)CC1C3.C=C(C)C(=O)OC1(C)CCC2CCCCC2C1.C=C(C)C(=O)OC1(C)CCCC2CCCCC21.C=C(C)C(=O)OC1(CCCC)C2CC3CC(C2)CC1C3.C=CC(=O)OC(C)(C)C.C=CC(=O)OC(C)(C)C(C)C.C=CC(=O)OC(C)(C)C12CC3CC(CC(C3)C1)C2.C=CC(=O)OC(C)(CCCC)C12CC3CC(CC(C3)C1)C2.

What is the InChIKey of 2-(1-adamantyl)hexan-2-yl prop-2-enoate;2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(1-adamantyl)propan-2-yl prop-2-enoate;(2-butyl-2-adamantyl) 2-methylprop-2-enoate;tert-butyl 2-methylprop-2-enoate;tert-butyl prop-2-enoate;2,3-dimethylbutan-2-yl prop-2-enoate;(1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate;(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl) 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate?

The InChIKey is RKUCKKLMGAEOSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30O2.C18H28O2.C17H26O2.C16H24O2.C15H22O2.2C15H24O2.2C9H16O2.C8H14O2.C7H12O2/c1-4-6-7-18(3,21-17(20)5-2)19-11-14-8-15(12-19)10-16(9-14)13-19;1-4-5-6-18(20-17(19)12(2)3)15-8-13-7-14(10-15)11-16(18)9-13;1-11(2)15(18)19-16(3,4)17-8-12-5-13(9-17)7-14(6-12)10-17;1-4-14(17)18-15(2,3)16-8-11-5-12(9-16)7-13(6-11)10-16;1-9(2)14(16)17-15(3)12-5-10-4-11(7-12)8-13(15)6-10;1-11(2)14(16)17-15(3)10-6-8-12-7-4-5-9-13(12)15;1-11(2)14(16)17-15(3)9-8-12-6-4-5-7-13(12)10-15;1-6-9(4,5)11-8(10)7(2)3;1-6-8(10)11-9(4,5)7(2)3;1-6(2)7(9)10-8(3,4)5;1-5-6(8)9-7(2,3)4/h5,14-16H,2,4,6-13H2,1,3H3;13-16H,2,4-11H2,1,3H3;12-14H,1,5-10H2,2-4H3;4,11-13H,1,5-10H2,2-3H3;10-13H,1,4-8H2,2-3H3;2*12-13H,1,4-10H2,2-3H3;2,6H2,1,3-5H3;6-7H,1H2,2-5H3;1H2,2-5H3;5H,1H2,2-4H3.

What are the key properties of 2-(1-adamantyl)hexan-2-yl prop-2-enoate;2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(1-adamantyl)propan-2-yl prop-2-enoate;(2-butyl-2-adamantyl) 2-methylprop-2-enoate;tert-butyl 2-methylprop-2-enoate;tert-butyl prop-2-enoate;2,3-dimethylbutan-2-yl prop-2-enoate;(1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate;(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl) 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate?

2-(1-adamantyl)hexan-2-yl prop-2-enoate;2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(1-adamantyl)propan-2-yl prop-2-enoate;(2-butyl-2-adamantyl) 2-methylprop-2-enoate;tert-butyl 2-methylprop-2-enoate;tert-butyl prop-2-enoate;2,3-dimethylbutan-2-yl prop-2-enoate;(1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate;(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl) 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate has a molecular weight of 2367.49 g/mol, XLogP of 36.08, 31 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(1-adamantyl)hexan-2-yl prop-2-enoate;2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(1-adamantyl)propan-2-yl prop-2-enoate;(2-butyl-2-adamantyl) 2-methylprop-2-enoate;tert-butyl 2-methylprop-2-enoate;tert-butyl prop-2-enoate;2,3-dimethylbutan-2-yl prop-2-enoate;(1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate;(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl) 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate is sourced from PubChem (CID 160653878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).