[5-(difluoromethyl)-2-pyridinyl]phosphane;ethane

C8H12F2NP — CID 144826758

IUPAC[5-(difluoromethyl)-2-pyridinyl]phosphane;ethane
SMILESCC.FC(F)c1ccc(P)nc1
InChIInChI=1S/C6H6F2NP.C2H6/c7-6(8)4-1-2-5(10)9-3-4;1-2/h1-3,6H,10H2;1-2H3
InChIKeyZXBUDJORGVKAIN-UHFFFAOYSA-N
MW191.16 g/mol
LogP2.55
Rot. Bonds1

About [5-(difluoromethyl)-2-pyridinyl]phosphane;ethane

[5-(difluoromethyl)-2-pyridinyl]phosphane;ethane (PubChem CID 144826758) has the molecular formula C8H12F2NP and a molecular weight of 191.16 g/mol. Its IUPAC name is [5-(difluoromethyl)-2-pyridinyl]phosphane;ethane.

Molecular Properties

Compound Name[5-(difluoromethyl)-2-pyridinyl]phosphane;ethane
PubChem CID144826758
Molecular FormulaC8H12F2NP
Molecular Weight191.16 g/mol
Exact Mass191.07
IUPAC Name[5-(difluoromethyl)-2-pyridinyl]phosphane;ethane
SMILESCC.FC(F)c1ccc(P)nc1
InChIInChI=1S/C6H6F2NP.C2H6/c7-6(8)4-1-2-5(10)9-3-4;1-2/h1-3,6H,10H2;1-2H3
InChIKeyZXBUDJORGVKAIN-UHFFFAOYSA-N
XLogP2.55
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.16
LogP ≤ 52.55
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 [5-(difluoromethyl)-2-pyridinyl]phosphane;ethane?
The IUPAC name of [5-(difluoromethyl)-2-pyridinyl]phosphane;ethane (CID 144826758) is [5-(difluoromethyl)-2-pyridinyl]phosphane;ethane.
What is the SMILES notation for [5-(difluoromethyl)-2-pyridinyl]phosphane;ethane?
The canonical SMILES for [5-(difluoromethyl)-2-pyridinyl]phosphane;ethane is CC.FC(F)c1ccc(P)nc1.
What is the InChIKey of [5-(difluoromethyl)-2-pyridinyl]phosphane;ethane?
The InChIKey is ZXBUDJORGVKAIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F2NP.C2H6/c7-6(8)4-1-2-5(10)9-3-4;1-2/h1-3,6H,10H2;1-2H3.
What are the key properties of [5-(difluoromethyl)-2-pyridinyl]phosphane;ethane?
[5-(difluoromethyl)-2-pyridinyl]phosphane;ethane has a molecular weight of 191.16 g/mol, XLogP of 2.55, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(difluoromethyl)-2-pyridinyl]phosphane;ethane is sourced from PubChem (CID 144826758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).