C153H378O32 — CID 159796122
1-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-4-methylpentane;1-[2-(2-ethoxyethoxy)ethoxy]-4-methylpentane;1-(2-ethoxyethoxy)-4-methylpentane;methane;1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-4-methylpentane;bis(1-[2-(2-methoxyethoxy)ethoxy]-4-methylpentane);1-(2-methoxyethoxymethoxy)-4-methylpentane;1-(2-methoxyethoxy)-4-methylpentane;1-(methoxymethoxy)-4-methylpentane;1-methoxy-4-methylpentane;4-methyl-1-[2-(2-propoxyethoxy)ethoxy]pentane;4-methyl-1-(2-propoxyethoxy)pentane (PubChem CID 159796122) has the molecular formula C153H378O32 and a molecular weight of 2730.68 g/mol. Its IUPAC name is 1-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-4-methylpentane;1-[2-(2-ethoxyethoxy)ethoxy]-4-methylpentane;1-(2-ethoxyethoxy)-4-methylpentane;methane;1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-4-methylpentane;bis(1-[2-(2-methoxyethoxy)ethoxy]-4-methylpentane);1-(2-methoxyethoxymethoxy)-4-methylpentane;1-(2-methoxyethoxy)-4-methylpentane;1-(methoxymethoxy)-4-methylpentane;1-methoxy-4-methylpentane;4-methyl-1-[2-(2-propoxyethoxy)ethoxy]pentane;4-methyl-1-(2-propoxyethoxy)pentane.
| Compound Name | 1-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-4-methylpentane;1-[2-(2-ethoxyethoxy)ethoxy]-4-methylpentane;1-(2-ethoxyethoxy)-4-methylpentane;methane;1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-4-methylpentane;bis(1-[2-(2-methoxyethoxy)ethoxy]-4-methylpentane);1-(2-methoxyethoxymethoxy)-4-methylpentane;1-(2-methoxyethoxy)-4-methylpentane;1-(methoxymethoxy)-4-methylpentane;1-methoxy-4-methylpentane;4-methyl-1-[2-(2-propoxyethoxy)ethoxy]pentane;4-methyl-1-(2-propoxyethoxy)pentane |
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| PubChem CID | 159796122 |
| Molecular Formula | C153H378O32 |
| Molecular Weight | 2730.68 g/mol |
| Exact Mass | 2728.80 |
| IUPAC Name | 1-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-4-methylpentane;1-[2-(2-ethoxyethoxy)ethoxy]-4-methylpentane;1-(2-ethoxyethoxy)-4-methylpentane;methane;1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-4-methylpentane;bis(1-[2-(2-methoxyethoxy)ethoxy]-4-methylpentane);1-(2-methoxyethoxymethoxy)-4-methylpentane;1-(2-methoxyethoxy)-4-methylpentane;1-(methoxymethoxy)-4-methylpentane;1-methoxy-4-methylpentane;4-methyl-1-[2-(2-propoxyethoxy)ethoxy]pentane;4-methyl-1-(2-propoxyethoxy)pentane |
| SMILES | C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CCCOCCOCCCC(C)C.CCCOCCOCCOCCCC(C)C.CCOCCOCCCC(C)C.CCOCCOCCOCCCC(C)C.CCOCCOCCOCCOCCCC(C)C.COCCCC(C)C.COCCOCCCC(C)C.COCCOCCOCCCC(C)C.COCCOCCOCCCC(C)C.COCCOCCOCCOCCCC(C)C.COCCOCOCCCC(C)C.COCOCCCC(C)C |
| InChI | InChI=1S/C14H30O4.C13H28O4.C13H28O3.C12H26O3.2C11H24O3.C11H24O2.C10H22O3.C10H22O2.C9H20O2.C8H18O2.C7H16O.24CH4/c1-4-15-8-9-17-12-13-18-11-10-16-7-5-6-14(2)3;1-13(2)5-4-6-15-9-10-17-12-11-16-8-7-14-3;1-4-7-14-9-11-16-12-10-15-8-5-6-13(2)3;1-4-13-8-9-15-11-10-14-7-5-6-12(2)3;2*1-11(2)5-4-6-13-9-10-14-8-7-12-3;1-4-7-12-9-10-13-8-5-6-11(2)3;1-10(2)5-4-6-12-9-13-8-7-11-3;1-4-11-8-9-12-7-5-6-10(2)3;1-9(2)5-4-6-11-8-7-10-3;1-8(2)5-4-6-10-7-9-3;1-7(2)5-4-6-8-3;;;;;;;;;;;;;;;;;;;;;;;;/h14H,4-13H2,1-3H3;13H,4-12H2,1-3H3;13H,4-12H2,1-3H3;12H,4-11H2,1-3H3;2*11H,4-10H2,1-3H3;11H,4-10H2,1-3H3;10H,4-9H2,1-3H3;10H,4-9H2,1-3H3;9H,4-8H2,1-3H3;8H,4-7H2,1-3H3;7H,4-6H2,1-3H3;24*1H4 |
| InChIKey | NJEURZVJBVEKFM-UHFFFAOYSA-N |
| XLogP | 43.07 |
| TPSA | 295.36 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 32 |
| Rotatable Bonds | 113 |
| Heavy Atoms | 185 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2730.68 |
| LogP ≤ 5 | 43.07 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 32 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'} |
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