2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane

C12H26O — CID 90946769

IUPAC2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane
SMILESCC(C)(C)OCC(C)(C)C(C)(C)C
InChIInChI=1S/C12H26O/c1-10(2,3)12(7,8)9-13-11(4,5)6/h9H2,1-8H3
InChIKeyVYTXWWHRABJUIQ-UHFFFAOYSA-N
MW186.34 g/mol
LogP3.87
Rot. Bonds2

About 2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane

2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane (PubChem CID 90946769) has the molecular formula C12H26O and a molecular weight of 186.34 g/mol. Its IUPAC name is 2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane.

Molecular Properties

Compound Name2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane
PubChem CID90946769
Molecular FormulaC12H26O
Molecular Weight186.34 g/mol
Exact Mass186.20
IUPAC Name2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane
SMILESCC(C)(C)OCC(C)(C)C(C)(C)C
InChIInChI=1S/C12H26O/c1-10(2,3)12(7,8)9-13-11(4,5)6/h9H2,1-8H3
InChIKeyVYTXWWHRABJUIQ-UHFFFAOYSA-N
XLogP3.87
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.34
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,1'-Oxybis(3,3-dimethylbutane)
CID 22662188
Butyl 1,1-dimethylpropyl ether
CID 520577
1,1-Dimethylethyl 3-methylbutyl ether
CID 21894291
2-Ethoxy-2,4,4-trimethylpentane
CID 22274771
Ether, tert-butyl 3,3-dimethylbutyl
CID 546092
Furan, tetrahydro-3,3,4,4-tetramethyl-
CID 21354952
1,1-Dimethylpropyl 3-methylbutyl ether
CID 12460096
3-Ethoxy-2,2-dimethylbutane
CID 12892133
Tetramethylather
CID 13316173
Pinacolyl ether
CID 13843575
1-(2,2-Dimethylbutoxy)-2,2-dimethylbutane
CID 17885937
(1,1-Dimethylethyl)-1-methylethyl ether
CID 18364477

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane?
The IUPAC name of 2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane (CID 90946769) is 2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane.
What is the SMILES notation for 2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane?
The canonical SMILES for 2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane is CC(C)(C)OCC(C)(C)C(C)(C)C.
What is the InChIKey of 2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane?
The InChIKey is VYTXWWHRABJUIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O/c1-10(2,3)12(7,8)9-13-11(4,5)6/h9H2,1-8H3.
What are the key properties of 2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane?
2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane has a molecular weight of 186.34 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetramethyl-1-[(2-methylpropan-2-yl)oxy]butane is sourced from PubChem (CID 90946769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).