2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate

C200H330O31 — CID 163429453

IUPAC2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC(C)(C)C12CC3CC(CC(C3)C1)C2.C=C(C)C(=O)OC(C)(C)C12CC3CC(CC(O)(C3)C1)C2.C=C(C)C(=O)OC(C)(C)C1CC2CCC1C2.C=C(C)C(=O)OC(C)(C)CC.C=C(C)C(=O)OC(C)(C)CCCC.C=C(C)C(=O)OC(C)(C)CCCC.C=C(C)C(=O)OC(C)(CC)CCCCC.C=C(C)C(=O)OC(CC)(C(C)C)C(C)(C)C.C=C(C)C(=O)OC(CC)(CC)C1CCCCC1.C=C(C)C(=O)OC(CC)(CC)CCC.C=C(C)C(=O)OC(CC)(CCCCC)C(C)C.C=C(C)C(=O)OC1(C)C2CC3CC(C2)CC1C3.C=C(C)C(=O)OC1(CC)CCCC1.C=C(C)C(=O)OC1(c2ccccc2)CCCC1.C=CC1(OC(=O)C(=C)C)CCCC1
InChIInChI=1S/C17H26O3.C17H26O2.C15H22O2.C15H18O2.C15H26O2.C15H28O2.C14H22O2.C14H26O2.C13H24O2.C12H22O2.C11H18O2.C11H16O2.2C11H20O2.C9H16O2/c1-11(2)14(18)20-15(3,4)16-6-12-5-13(7-16)9-17(19,8-12)10-16;1-11(2)15(18)19-16(3,4)17-8-12-5-13(9-17)7-14(6-12)10-17;1-9(2)14(16)17-15(3)12-5-10-4-11(7-12)8-13(15)6-10;1-12(2)14(16)17-15(10-6-7-11-15)13-8-4-3-5-9-13;1-5-15(6-2,17-14(16)12(3)4)13-10-8-7-9-11-13;1-7-9-10-11-15(8-2,13(5)6)17-14(16)12(3)4;1-9(2)13(15)16-14(3,4)12-8-10-5-6-11(12)7-10;1-9-14(11(4)5,13(6,7)8)16-12(15)10(2)3;1-6-8-9-10-13(5,7-2)15-12(14)11(3)4;1-6-9-12(7-2,8-3)14-11(13)10(4)5;2*1-4-11(7-5-6-8-11)13-10(12)9(2)3;2*1-6-7-8-11(4,5)13-10(12)9(2)3;1-6-9(4,5)11-8(10)7(2)3/h12-13,19H,1,5-10H2,2-4H3;12-14H,1,5-10H2,2-4H3;10-13H,1,4-8H2,2-3H3;3-5,8-9H,1,6-7,10-11H2,2H3;13H,3,5-11H2,1-2,4H3;13H,3,7-11H2,1-2,4-6H3;10-12H,1,5-8H2,2-4H3;11H,2,9H2,1,3-8H3;3,6-10H2,1-2,4-5H3;4,6-9H2,1-3,5H3;2,4-8H2,1,3H3;4H,1-2,5-8H2,3H3;2*2,6-8H2,1,3-5H3;2,6H2,1,3-5H3
InChIKeyAPFORDODZHIJOM-UHFFFAOYSA-N
MW3230.81 g/mol
LogP51.42
Rot. Bonds63

About 2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate

2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate (PubChem CID 163429453) has the molecular formula C200H330O31 and a molecular weight of 3230.81 g/mol. Its IUPAC name is 2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate.

Molecular Properties

Compound Name2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate
PubChem CID163429453
Molecular FormulaC200H330O31
Molecular Weight3230.81 g/mol
Exact Mass3228.42
IUPAC Name2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC(C)(C)C12CC3CC(CC(C3)C1)C2.C=C(C)C(=O)OC(C)(C)C12CC3CC(CC(O)(C3)C1)C2.C=C(C)C(=O)OC(C)(C)C1CC2CCC1C2.C=C(C)C(=O)OC(C)(C)CC.C=C(C)C(=O)OC(C)(C)CCCC.C=C(C)C(=O)OC(C)(C)CCCC.C=C(C)C(=O)OC(C)(CC)CCCCC.C=C(C)C(=O)OC(CC)(C(C)C)C(C)(C)C.C=C(C)C(=O)OC(CC)(CC)C1CCCCC1.C=C(C)C(=O)OC(CC)(CC)CCC.C=C(C)C(=O)OC(CC)(CCCCC)C(C)C.C=C(C)C(=O)OC1(C)C2CC3CC(C2)CC1C3.C=C(C)C(=O)OC1(CC)CCCC1.C=C(C)C(=O)OC1(c2ccccc2)CCCC1.C=CC1(OC(=O)C(=C)C)CCCC1
InChIInChI=1S/C17H26O3.C17H26O2.C15H22O2.C15H18O2.C15H26O2.C15H28O2.C14H22O2.C14H26O2.C13H24O2.C12H22O2.C11H18O2.C11H16O2.2C11H20O2.C9H16O2/c1-11(2)14(18)20-15(3,4)16-6-12-5-13(7-16)9-17(19,8-12)10-16;1-11(2)15(18)19-16(3,4)17-8-12-5-13(9-17)7-14(6-12)10-17;1-9(2)14(16)17-15(3)12-5-10-4-11(7-12)8-13(15)6-10;1-12(2)14(16)17-15(10-6-7-11-15)13-8-4-3-5-9-13;1-5-15(6-2,17-14(16)12(3)4)13-10-8-7-9-11-13;1-7-9-10-11-15(8-2,13(5)6)17-14(16)12(3)4;1-9(2)13(15)16-14(3,4)12-8-10-5-6-11(12)7-10;1-9-14(11(4)5,13(6,7)8)16-12(15)10(2)3;1-6-8-9-10-13(5,7-2)15-12(14)11(3)4;1-6-9-12(7-2,8-3)14-11(13)10(4)5;2*1-4-11(7-5-6-8-11)13-10(12)9(2)3;2*1-6-7-8-11(4,5)13-10(12)9(2)3;1-6-9(4,5)11-8(10)7(2)3/h12-13,19H,1,5-10H2,2-4H3;12-14H,1,5-10H2,2-4H3;10-13H,1,4-8H2,2-3H3;3-5,8-9H,1,6-7,10-11H2,2H3;13H,3,5-11H2,1-2,4H3;13H,3,7-11H2,1-2,4-6H3;10-12H,1,5-8H2,2-4H3;11H,2,9H2,1,3-8H3;3,6-10H2,1-2,4-5H3;4,6-9H2,1-3,5H3;2,4-8H2,1,3H3;4H,1-2,5-8H2,3H3;2*2,6-8H2,1,3-5H3;2,6H2,1,3-5H3
InChIKeyAPFORDODZHIJOM-UHFFFAOYSA-N
XLogP51.42
TPSA414.73 Ų
H-Bond Donors1
H-Bond Acceptors31
Rotatable Bonds63
Heavy Atoms231
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003230.81
LogP ≤ 551.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1031

Computed Properties (RDKit)

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

Analyze 2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate?
The IUPAC name of 2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate (CID 163429453) is 2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate.
What is the SMILES notation for 2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate?
The canonical SMILES for 2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate is C=C(C)C(=O)OC(C)(C)C12CC3CC(CC(C3)C1)C2.C=C(C)C(=O)OC(C)(C)C12CC3CC(CC(O)(C3)C1)C2.C=C(C)C(=O)OC(C)(C)C1CC2CCC1C2.C=C(C)C(=O)OC(C)(C)CC.C=C(C)C(=O)OC(C)(C)CCCC.C=C(C)C(=O)OC(C)(C)CCCC.C=C(C)C(=O)OC(C)(CC)CCCCC.C=C(C)C(=O)OC(CC)(C(C)C)C(C)(C)C.C=C(C)C(=O)OC(CC)(CC)C1CCCCC1.C=C(C)C(=O)OC(CC)(CC)CCC.C=C(C)C(=O)OC(CC)(CCCCC)C(C)C.C=C(C)C(=O)OC1(C)C2CC3CC(C2)CC1C3.C=C(C)C(=O)OC1(CC)CCCC1.C=C(C)C(=O)OC1(c2ccccc2)CCCC1.C=CC1(OC(=O)C(=C)C)CCCC1.
What is the InChIKey of 2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate?
The InChIKey is APFORDODZHIJOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O3.C17H26O2.C15H22O2.C15H18O2.C15H26O2.C15H28O2.C14H22O2.C14H26O2.C13H24O2.C12H22O2.C11H18O2.C11H16O2.2C11H20O2.C9H16O2/c1-11(2)14(18)20-15(3,4)16-6-12-5-13(7-16)9-17(19,8-12)10-16;1-11(2)15(18)19-16(3,4)17-8-12-5-13(9-17)7-14(6-12)10-17;1-9(2)14(16)17-15(3)12-5-10-4-11(7-12)8-13(15)6-10;1-12(2)14(16)17-15(10-6-7-11-15)13-8-4-3-5-9-13;1-5-15(6-2,17-14(16)12(3)4)13-10-8-7-9-11-13;1-7-9-10-11-15(8-2,13(5)6)17-14(16)12(3)4;1-9(2)13(15)16-14(3,4)12-8-10-5-6-11(12)7-10;1-9-14(11(4)5,13(6,7)8)16-12(15)10(2)3;1-6-8-9-10-13(5,7-2)15-12(14)11(3)4;1-6-9-12(7-2,8-3)14-11(13)10(4)5;2*1-4-11(7-5-6-8-11)13-10(12)9(2)3;2*1-6-7-8-11(4,5)13-10(12)9(2)3;1-6-9(4,5)11-8(10)7(2)3/h12-13,19H,1,5-10H2,2-4H3;12-14H,1,5-10H2,2-4H3;10-13H,1,4-8H2,2-3H3;3-5,8-9H,1,6-7,10-11H2,2H3;13H,3,5-11H2,1-2,4H3;13H,3,7-11H2,1-2,4-6H3;10-12H,1,5-8H2,2-4H3;11H,2,9H2,1,3-8H3;3,6-10H2,1-2,4-5H3;4,6-9H2,1-3,5H3;2,4-8H2,1,3H3;4H,1-2,5-8H2,3H3;2*2,6-8H2,1,3-5H3;2,6H2,1,3-5H3.
What are the key properties of 2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate?
2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate has a molecular weight of 3230.81 g/mol, XLogP of 51.42, 63 rotatable bonds, 1 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-adamantyl)propan-2-yl 2-methylprop-2-enoate;2-(2-bicyclo[2.2.1]heptanyl)propan-2-yl 2-methylprop-2-enoate;3-cyclohexylpentan-3-yl 2-methylprop-2-enoate;(1-ethenylcyclopentyl) 2-methylprop-2-enoate;(1-ethylcyclopentyl) 2-methylprop-2-enoate;3-ethylhexan-3-yl 2-methylprop-2-enoate;(3-ethyl-2-methyloctan-3-yl) 2-methylprop-2-enoate;(3-ethyl-2,2,4-trimethylpentan-3-yl) 2-methylprop-2-enoate;2-(3-hydroxy-1-adamantyl)propan-2-yl 2-methylprop-2-enoate;(2-methyl-2-adamantyl) 2-methylprop-2-enoate;2-methylbutan-2-yl 2-methylprop-2-enoate;bis(2-methylhexan-2-yl 2-methylprop-2-enoate);3-methyloctan-3-yl 2-methylprop-2-enoate;(1-phenylcyclopentyl) 2-methylprop-2-enoate is sourced from PubChem (CID 163429453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).