perchloric acid;2,2,6,6-tetramethylpiperidin-4-one

C9H18ClNO5 — CID 71399503

IUPACperchloric acid;2,2,6,6-tetramethylpiperidin-4-one
SMILESCC1(C)CC(=O)CC(C)(C)N1.[O-][Cl+3]([O-])([O-])O
InChIInChI=1S/C9H17NO.ClHO4/c1-8(2)5-7(11)6-9(3,4)10-8;2-1(3,4)5/h10H,5-6H2,1-4H3;(H,2,3,4,5)
InChIKeyYMRISLLSIKGDBX-UHFFFAOYSA-N
MW255.70 g/mol
LogP-2.63
Rot. Bonds

About perchloric acid;2,2,6,6-tetramethylpiperidin-4-one

perchloric acid;2,2,6,6-tetramethylpiperidin-4-one (PubChem CID 71399503) has the molecular formula C9H18ClNO5 and a molecular weight of 255.70 g/mol. Its IUPAC name is perchloric acid;2,2,6,6-tetramethylpiperidin-4-one.

Molecular Properties

Compound Nameperchloric acid;2,2,6,6-tetramethylpiperidin-4-one
PubChem CID71399503
Molecular FormulaC9H18ClNO5
Molecular Weight255.70 g/mol
Exact Mass255.09
IUPAC Nameperchloric acid;2,2,6,6-tetramethylpiperidin-4-one
SMILESCC1(C)CC(=O)CC(C)(C)N1.[O-][Cl+3]([O-])([O-])O
InChIInChI=1S/C9H17NO.ClHO4/c1-8(2)5-7(11)6-9(3,4)10-8;2-1(3,4)5/h10H,5-6H2,1-4H3;(H,2,3,4,5)
InChIKeyYMRISLLSIKGDBX-UHFFFAOYSA-N
XLogP-2.63
TPSA118.51 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.70
LogP ≤ 5-2.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of perchloric acid;2,2,6,6-tetramethylpiperidin-4-one?
The IUPAC name of perchloric acid;2,2,6,6-tetramethylpiperidin-4-one (CID 71399503) is perchloric acid;2,2,6,6-tetramethylpiperidin-4-one.
What is the SMILES notation for perchloric acid;2,2,6,6-tetramethylpiperidin-4-one?
The canonical SMILES for perchloric acid;2,2,6,6-tetramethylpiperidin-4-one is CC1(C)CC(=O)CC(C)(C)N1.[O-][Cl+3]([O-])([O-])O.
What is the InChIKey of perchloric acid;2,2,6,6-tetramethylpiperidin-4-one?
The InChIKey is YMRISLLSIKGDBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO.ClHO4/c1-8(2)5-7(11)6-9(3,4)10-8;2-1(3,4)5/h10H,5-6H2,1-4H3;(H,2,3,4,5).
What are the key properties of perchloric acid;2,2,6,6-tetramethylpiperidin-4-one?
perchloric acid;2,2,6,6-tetramethylpiperidin-4-one has a molecular weight of 255.70 g/mol, XLogP of -2.63, 0 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for perchloric acid;2,2,6,6-tetramethylpiperidin-4-one is sourced from PubChem (CID 71399503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).