2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride

C8H19ClO — CID 18938161

IUPAC2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride
SMILESCC(C)(C)OC(C)(C)C.Cl
InChIInChI=1S/C8H18O.ClH/c1-7(2,3)9-8(4,5)6;/h1-6H3;1H
InChIKeyMPGMQOLNYWGJFI-UHFFFAOYSA-N
MW166.69 g/mol
LogP3.02
Rot. Bonds

About 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride

2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride (PubChem CID 18938161) has the molecular formula C8H19ClO and a molecular weight of 166.69 g/mol. Its IUPAC name is 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride.

Molecular Properties

Compound Name2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride
PubChem CID18938161
Molecular FormulaC8H19ClO
Molecular Weight166.69 g/mol
Exact Mass166.11
IUPAC Name2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride
SMILESCC(C)(C)OC(C)(C)C.Cl
InChIInChI=1S/C8H18O.ClH/c1-7(2,3)9-8(4,5)6;/h1-6H3;1H
InChIKeyMPGMQOLNYWGJFI-UHFFFAOYSA-N
XLogP3.02
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.69
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride?
The IUPAC name of 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride (CID 18938161) is 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride.
What is the SMILES notation for 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride?
The canonical SMILES for 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride is CC(C)(C)OC(C)(C)C.Cl.
What is the InChIKey of 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride?
The InChIKey is MPGMQOLNYWGJFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O.ClH/c1-7(2,3)9-8(4,5)6;/h1-6H3;1H.
What are the key properties of 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride?
2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride has a molecular weight of 166.69 g/mol, XLogP of 3.02, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride is sourced from PubChem (CID 18938161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).