2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane

C177H389Br3O37 — CID 157466124

IUPAC2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane
SMILESC#CCCOC(C)(C)C.C#CCOC(C)(C)C.CC(C)(C)OCCBr.CC(C)(C)OC[C@@H](O)CBr.CC(C)(C)OC[C@H](O)CBr.CCC(O)COC(C)(C)C.CCC(O)COC(C)(C)C.CCC(O)COC(C)(C)C.CCC(O)COC(C)(C)C.CCCCOC(C)(C)C.CCCCOC(C)(C)C.CCCCOC(C)(C)C.CCCCOC(C)(C)C.CCCOC(C)(C)C.CCCOCCOCCOC(C)(C)C.CCOC(C)(C)C.CCOC(C)(C)C.CC[C@@H](O)COC(C)(C)C.CC[C@@H](O)COC(C)(C)C.CC[C@@H](O)COC(C)(C)C.CC[C@H](O)COC(C)(C)C.CC[C@H](O)COC(C)(C)C.CC[C@H](O)COC(C)(C)C
InChIInChI=1S/C11H24O3.10C8H18O2.4C8H18O.C8H14O.2C7H15BrO2.C7H16O.C7H12O.C6H13BrO.2C6H14O/c1-5-6-12-7-8-13-9-10-14-11(2,3)4;10*1-5-7(9)6-10-8(2,3)4;5*1-5-6-7-9-8(2,3)4;2*1-7(2,3)10-5-6(9)4-8;2*1-5-6-8-7(2,3)4;1-6(2,3)8-5-4-7;2*1-5-7-6(2,3)4/h5-10H2,1-4H3;10*7,9H,5-6H2,1-4H3;4*5-7H2,1-4H3;1H,6-7H2,2-4H3;2*6,9H,4-5H2,1-3H3;5-6H2,1-4H3;1H,6H2,2-4H3;4-5H2,1-3H3;2*5H2,1-4H3/t;6*7-;;;;;;;;;;2*6-;;;;;/m.111000.........10...../s1
InChIKeyBUMPYTQCULQWQV-XEJPVXHXSA-N
MW3349.73 g/mol
LogP42.80
Rot. Bonds65

About 2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane

2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane (PubChem CID 157466124) has the molecular formula C177H389Br3O37 and a molecular weight of 3349.73 g/mol. Its IUPAC name is 2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane.

Molecular Properties

Compound Name2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane
PubChem CID157466124
Molecular FormulaC177H389Br3O37
Molecular Weight3349.73 g/mol
Exact Mass3344.61
IUPAC Name2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane
SMILESC#CCCOC(C)(C)C.C#CCOC(C)(C)C.CC(C)(C)OCCBr.CC(C)(C)OC[C@@H](O)CBr.CC(C)(C)OC[C@H](O)CBr.CCC(O)COC(C)(C)C.CCC(O)COC(C)(C)C.CCC(O)COC(C)(C)C.CCC(O)COC(C)(C)C.CCCCOC(C)(C)C.CCCCOC(C)(C)C.CCCCOC(C)(C)C.CCCCOC(C)(C)C.CCCOC(C)(C)C.CCCOCCOCCOC(C)(C)C.CCOC(C)(C)C.CCOC(C)(C)C.CC[C@@H](O)COC(C)(C)C.CC[C@@H](O)COC(C)(C)C.CC[C@@H](O)COC(C)(C)C.CC[C@H](O)COC(C)(C)C.CC[C@H](O)COC(C)(C)C.CC[C@H](O)COC(C)(C)C
InChIInChI=1S/C11H24O3.10C8H18O2.4C8H18O.C8H14O.2C7H15BrO2.C7H16O.C7H12O.C6H13BrO.2C6H14O/c1-5-6-12-7-8-13-9-10-14-11(2,3)4;10*1-5-7(9)6-10-8(2,3)4;5*1-5-6-7-9-8(2,3)4;2*1-7(2,3)10-5-6(9)4-8;2*1-5-6-8-7(2,3)4;1-6(2,3)8-5-4-7;2*1-5-7-6(2,3)4/h5-10H2,1-4H3;10*7,9H,5-6H2,1-4H3;4*5-7H2,1-4H3;1H,6-7H2,2-4H3;2*6,9H,4-5H2,1-3H3;5-6H2,1-4H3;1H,6H2,2-4H3;4-5H2,1-3H3;2*5H2,1-4H3/t;6*7-;;;;;;;;;;2*6-;;;;;/m.111000.........10...../s1
InChIKeyBUMPYTQCULQWQV-XEJPVXHXSA-N
XLogP42.80
TPSA473.51 Ų
H-Bond Donors12
H-Bond Acceptors37
Rotatable Bonds65
Heavy Atoms217
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003349.73
LogP ≤ 542.80
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane?
The IUPAC name of 2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane (CID 157466124) is 2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane.
What is the SMILES notation for 2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane?
The canonical SMILES for 2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane is C#CCCOC(C)(C)C.C#CCOC(C)(C)C.CC(C)(C)OCCBr.CC(C)(C)OC[C@@H](O)CBr.CC(C)(C)OC[C@H](O)CBr.CCC(O)COC(C)(C)C.CCC(O)COC(C)(C)C.CCC(O)COC(C)(C)C.CCC(O)COC(C)(C)C.CCCCOC(C)(C)C.CCCCOC(C)(C)C.CCCCOC(C)(C)C.CCCCOC(C)(C)C.CCCOC(C)(C)C.CCCOCCOCCOC(C)(C)C.CCOC(C)(C)C.CCOC(C)(C)C.CC[C@@H](O)COC(C)(C)C.CC[C@@H](O)COC(C)(C)C.CC[C@@H](O)COC(C)(C)C.CC[C@H](O)COC(C)(C)C.CC[C@H](O)COC(C)(C)C.CC[C@H](O)COC(C)(C)C.
What is the InChIKey of 2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane?
The InChIKey is BUMPYTQCULQWQV-XEJPVXHXSA-N. The full InChI is InChI=1S/C11H24O3.10C8H18O2.4C8H18O.C8H14O.2C7H15BrO2.C7H16O.C7H12O.C6H13BrO.2C6H14O/c1-5-6-12-7-8-13-9-10-14-11(2,3)4;10*1-5-7(9)6-10-8(2,3)4;5*1-5-6-7-9-8(2,3)4;2*1-7(2,3)10-5-6(9)4-8;2*1-5-6-8-7(2,3)4;1-6(2,3)8-5-4-7;2*1-5-7-6(2,3)4/h5-10H2,1-4H3;10*7,9H,5-6H2,1-4H3;4*5-7H2,1-4H3;1H,6-7H2,2-4H3;2*6,9H,4-5H2,1-3H3;5-6H2,1-4H3;1H,6H2,2-4H3;4-5H2,1-3H3;2*5H2,1-4H3/t;6*7-;;;;;;;;;;2*6-;;;;;/m.111000.........10...../s1.
What are the key properties of 2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane?
2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane has a molecular weight of 3349.73 g/mol, XLogP of 42.80, 65 rotatable bonds, 12 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromoethoxy)-2-methylpropane;(2S)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;(2R)-1-bromo-3-[(2-methylpropan-2-yl)oxy]propan-2-ol;2-but-3-ynoxy-2-methylpropane;bis(2-ethoxy-2-methylpropane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butane);tetrakis(1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);tris((2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol);2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane;2-methyl-2-propoxypropane;2-methyl-2-prop-2-ynoxypropane is sourced from PubChem (CID 157466124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).