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

C9H23ClO — CID 87152228

IUPACmethane;2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride
SMILESC.CC(C)(C)OC(C)(C)C.Cl
InChIInChI=1S/C8H18O.CH4.ClH/c1-7(2,3)9-8(4,5)6;;/h1-6H3;1H4;1H
InChIKeyHCPXIZGPZANTIY-UHFFFAOYSA-N
MW182.73 g/mol
LogP3.66
Rot. Bonds

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

methane;2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride (PubChem CID 87152228) has the molecular formula C9H23ClO and a molecular weight of 182.73 g/mol. Its IUPAC name is methane;2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride.

Molecular Properties

Compound Namemethane;2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride
PubChem CID87152228
Molecular FormulaC9H23ClO
Molecular Weight182.73 g/mol
Exact Mass182.14
IUPAC Namemethane;2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride
SMILESC.CC(C)(C)OC(C)(C)C.Cl
InChIInChI=1S/C8H18O.CH4.ClH/c1-7(2,3)9-8(4,5)6;;/h1-6H3;1H4;1H
InChIKeyHCPXIZGPZANTIY-UHFFFAOYSA-N
XLogP3.66
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.73
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of methane;2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride?
The IUPAC name of methane;2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride (CID 87152228) is methane;2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride.
What is the SMILES notation for methane;2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride?
The canonical SMILES for methane;2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride is C.CC(C)(C)OC(C)(C)C.Cl.
What is the InChIKey of methane;2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride?
The InChIKey is HCPXIZGPZANTIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O.CH4.ClH/c1-7(2,3)9-8(4,5)6;;/h1-6H3;1H4;1H.
What are the key properties of methane;2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride?
methane;2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride has a molecular weight of 182.73 g/mol, XLogP of 3.66, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methane;2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;hydrochloride is sourced from PubChem (CID 87152228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).