1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium
C162H296N20S4+12 — CID 159464319
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPAC1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium
SMILESC.C.C.C.C.C.C.C.C.C.C.C.CC(C)C1CCC(C[n+]2ccsc2)C1.CC(C)C1CCC(C[n+]2ccsc2)CC1.CC(C)C1CCC(Cn2cc[n+](C)c2)C1.CC(C)C1CCC(Cn2cc[n+](C)c2)CC1.CC(C)CC[n+]1ccsc1.CC(C)CCn1cc[n+](C)c1.CC(C)c1ccc(C[n+]2ccsc2)cc1.CC(C)c1ccc(Cn2cc[n+](C)c2)cc1.CCn1cc[n+](CC2CCC(C(C)C)C2)c1.CCn1cc[n+](CC2CCC(C(C)C)CC2)c1.CCn1cc[n+](CCC(C)C)c1.CCn1cc[n+](Cc2ccc(C(C)C)cc2)c1
InChIInChI=1S/C15H27N2.C15H21N2.C14H25N2.C14H19N2.C14H25N2.C13H23N2.C13H22NS.C13H16NS.C12H20NS.C10H19N2.C9H17N2.C8H14NS.12CH4/c2*1-4-16-9-10-17(12-16)11-14-5-7-15(8-6-14)13(2)3;2*1-12(2)14-6-4-13(5-7-14)10-16-9-8-15(3)11-16;1-4-15-7-8-16(11-15)10-13-5-6-14(9-13)12(2)3;1-11(2)13-5-4-12(8-13)9-15-7-6-14(3)10-15;2*1-11(2)13-5-3-12(4-6-13)9-14-7-8-15-10-14;1-10(2)12-4-3-11(7-12)8-13-5-6-14-9-13;1-4-11-7-8-12(9-11)6-5-10(2)3;1-9(2)4-5-11-7-6-10(3)8-11;1-8(2)3-4-9-5-6-10-7-9;;;;;;;;;;;;/h9-10,12-15H,4-8,11H2,1-3H3;5-10,12-13H,4,11H2,1-3H3;8-9,11-14H,4-7,10H2,1-3H3;4-9,11-12H,10H2,1-3H3;7-8,11-14H,4-6,9-10H2,1-3H3;6-7,10-13H,4-5,8-9H2,1-3H3;7-8,10-13H,3-6,9H2,1-2H3;3-8,10-11H,9H2,1-2H3;5-6,9-12H,3-4,7-8H2,1-2H3;7-10H,4-6H2,1-3H3;6-9H,4-5H2,1-3H3;5-8H,3-4H2,1-2H3;12*1H4/q12*+1;;;;;;;;;;;;
InChIKeyLUZIEFKNEAPISD-UHFFFAOYSA-N
MW2652.56 g/mol
LogP39.47
Rot. Bonds40
About 1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium
1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium (PubChem CID 159464319) has the molecular formula C162H296N20S4+12 and a molecular weight of 2652.56 g/mol. Its IUPAC name is 1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium.
Molecular Properties
| Compound Name | 1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium |
|---|---|
| PubChem CID | 159464319 |
| Molecular Formula | C162H296N20S4+12 |
| Molecular Weight | 2652.56 g/mol |
| Exact Mass | 2650.26 |
| IUPAC Name | 1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium |
| SMILES | C.C.C.C.C.C.C.C.C.C.C.C.CC(C)C1CCC(C[n+]2ccsc2)C1.CC(C)C1CCC(C[n+]2ccsc2)CC1.CC(C)C1CCC(Cn2cc[n+](C)c2)C1.CC(C)C1CCC(Cn2cc[n+](C)c2)CC1.CC(C)CC[n+]1ccsc1.CC(C)CCn1cc[n+](C)c1.CC(C)c1ccc(C[n+]2ccsc2)cc1.CC(C)c1ccc(Cn2cc[n+](C)c2)cc1.CCn1cc[n+](CC2CCC(C(C)C)C2)c1.CCn1cc[n+](CC2CCC(C(C)C)CC2)c1.CCn1cc[n+](CCC(C)C)c1.CCn1cc[n+](Cc2ccc(C(C)C)cc2)c1 |
| InChI | InChI=1S/C15H27N2.C15H21N2.C14H25N2.C14H19N2.C14H25N2.C13H23N2.C13H22NS.C13H16NS.C12H20NS.C10H19N2.C9H17N2.C8H14NS.12CH4/c2*1-4-16-9-10-17(12-16)11-14-5-7-15(8-6-14)13(2)3;2*1-12(2)14-6-4-13(5-7-14)10-16-9-8-15(3)11-16;1-4-15-7-8-16(11-15)10-13-5-6-14(9-13)12(2)3;1-11(2)13-5-4-12(8-13)9-15-7-6-14(3)10-15;2*1-11(2)13-5-3-12(4-6-13)9-14-7-8-15-10-14;1-10(2)12-4-3-11(7-12)8-13-5-6-14-9-13;1-4-11-7-8-12(9-11)6-5-10(2)3;1-9(2)4-5-11-7-6-10(3)8-11;1-8(2)3-4-9-5-6-10-7-9;;;;;;;;;;;;/h9-10,12-15H,4-8,11H2,1-3H3;5-10,12-13H,4,11H2,1-3H3;8-9,11-14H,4-7,10H2,1-3H3;4-9,11-12H,10H2,1-3H3;7-8,11-14H,4-6,9-10H2,1-3H3;6-7,10-13H,4-5,8-9H2,1-3H3;7-8,10-13H,3-6,9H2,1-2H3;3-8,10-11H,9H2,1-2H3;5-6,9-12H,3-4,7-8H2,1-2H3;7-10H,4-6H2,1-3H3;6-9H,4-5H2,1-3H3;5-8H,3-4H2,1-2H3;12*1H4/q12*+1;;;;;;;;;;;; |
| InChIKey | LUZIEFKNEAPISD-UHFFFAOYSA-N |
| XLogP | 39.47 |
| TPSA | 86.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 40 |
| Heavy Atoms | 186 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2652.56 |
| LogP ≤ 5 | 39.47 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'} |
|---|
Frequently Asked Questions
What is the IUPAC name of 1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium?
The IUPAC name of 1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium (CID 159464319) is 1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium.
What is the SMILES notation for 1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium?
The canonical SMILES for 1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium is C.C.C.C.C.C.C.C.C.C.C.C.CC(C)C1CCC(C[n+]2ccsc2)C1.CC(C)C1CCC(C[n+]2ccsc2)CC1.CC(C)C1CCC(Cn2cc[n+](C)c2)C1.CC(C)C1CCC(Cn2cc[n+](C)c2)CC1.CC(C)CC[n+]1ccsc1.CC(C)CCn1cc[n+](C)c1.CC(C)c1ccc(C[n+]2ccsc2)cc1.CC(C)c1ccc(Cn2cc[n+](C)c2)cc1.CCn1cc[n+](CC2CCC(C(C)C)C2)c1.CCn1cc[n+](CC2CCC(C(C)C)CC2)c1.CCn1cc[n+](CCC(C)C)c1.CCn1cc[n+](Cc2ccc(C(C)C)cc2)c1.
What is the InChIKey of 1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium?
The InChIKey is LUZIEFKNEAPISD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N2.C15H21N2.C14H25N2.C14H19N2.C14H25N2.C13H23N2.C13H22NS.C13H16NS.C12H20NS.C10H19N2.C9H17N2.C8H14NS.12CH4/c2*1-4-16-9-10-17(12-16)11-14-5-7-15(8-6-14)13(2)3;2*1-12(2)14-6-4-13(5-7-14)10-16-9-8-15(3)11-16;1-4-15-7-8-16(11-15)10-13-5-6-14(9-13)12(2)3;1-11(2)13-5-4-12(8-13)9-15-7-6-14(3)10-15;2*1-11(2)13-5-3-12(4-6-13)9-14-7-8-15-10-14;1-10(2)12-4-3-11(7-12)8-13-5-6-14-9-13;1-4-11-7-8-12(9-11)6-5-10(2)3;1-9(2)4-5-11-7-6-10(3)8-11;1-8(2)3-4-9-5-6-10-7-9;;;;;;;;;;;;/h9-10,12-15H,4-8,11H2,1-3H3;5-10,12-13H,4,11H2,1-3H3;8-9,11-14H,4-7,10H2,1-3H3;4-9,11-12H,10H2,1-3H3;7-8,11-14H,4-6,9-10H2,1-3H3;6-7,10-13H,4-5,8-9H2,1-3H3;7-8,10-13H,3-6,9H2,1-2H3;3-8,10-11H,9H2,1-2H3;5-6,9-12H,3-4,7-8H2,1-2H3;7-10H,4-6H2,1-3H3;6-9H,4-5H2,1-3H3;5-8H,3-4H2,1-2H3;12*1H4/q12*+1;;;;;;;;;;;;.
What are the key properties of 1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium?
1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium has a molecular weight of 2652.56 g/mol, XLogP of 39.47, 40 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium is sourced from PubChem (CID 159464319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
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Sources
- PubChem CID 159464319 — identifiers, structure, computed properties (public domain)
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