chloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane

C9H19ClNP — CID 16696546

IUPACchloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane
SMILESCC1(C)CCCC(C)(C)N1PCl
InChIInChI=1S/C9H19ClNP/c1-8(2)6-5-7-9(3,4)11(8)12-10/h12H,5-7H2,1-4H3
InChIKeyPVVROFNGQMPMES-UHFFFAOYSA-N
MW207.68 g/mol
LogP3.78
Rot. Bonds1

About chloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane

chloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane (PubChem CID 16696546) has the molecular formula C9H19ClNP and a molecular weight of 207.68 g/mol. Its IUPAC name is chloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane.

Molecular Properties

Compound Namechloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane
PubChem CID16696546
Molecular FormulaC9H19ClNP
Molecular Weight207.68 g/mol
Exact Mass207.09
IUPAC Namechloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane
SMILESCC1(C)CCCC(C)(C)N1PCl
InChIInChI=1S/C9H19ClNP/c1-8(2)6-5-7-9(3,4)11(8)12-10/h12H,5-7H2,1-4H3
InChIKeyPVVROFNGQMPMES-UHFFFAOYSA-N
XLogP3.78
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.68
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of chloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane?
The IUPAC name of chloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane (CID 16696546) is chloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane.
What is the SMILES notation for chloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane?
The canonical SMILES for chloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane is CC1(C)CCCC(C)(C)N1PCl.
What is the InChIKey of chloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane?
The InChIKey is PVVROFNGQMPMES-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19ClNP/c1-8(2)6-5-7-9(3,4)11(8)12-10/h12H,5-7H2,1-4H3.
What are the key properties of chloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane?
chloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane has a molecular weight of 207.68 g/mol, XLogP of 3.78, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(2,2,6,6-tetramethylpiperidin-1-yl)phosphane is sourced from PubChem (CID 16696546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).