dimethyl-(2,3,5,6-tetrafluorophenyl)phosphane

C8H7F4P — CID 102015616

IUPACdimethyl-(2,3,5,6-tetrafluorophenyl)phosphane
SMILESCP(C)c1c(F)c(F)cc(F)c1F
InChIInChI=1S/C8H7F4P/c1-13(2)8-6(11)4(9)3-5(10)7(8)12/h3H,1-2H3
InChIKeyDIBFVISOFGRRIT-UHFFFAOYSA-N
MW210.11 g/mol
LogP2.61
Rot. Bonds1

About dimethyl-(2,3,5,6-tetrafluorophenyl)phosphane

dimethyl-(2,3,5,6-tetrafluorophenyl)phosphane (PubChem CID 102015616) has the molecular formula C8H7F4P and a molecular weight of 210.11 g/mol. Its IUPAC name is dimethyl-(2,3,5,6-tetrafluorophenyl)phosphane.

Molecular Properties

Compound Namedimethyl-(2,3,5,6-tetrafluorophenyl)phosphane
PubChem CID102015616
Molecular FormulaC8H7F4P
Molecular Weight210.11 g/mol
Exact Mass210.02
IUPAC Namedimethyl-(2,3,5,6-tetrafluorophenyl)phosphane
SMILESCP(C)c1c(F)c(F)cc(F)c1F
InChIInChI=1S/C8H7F4P/c1-13(2)8-6(11)4(9)3-5(10)7(8)12/h3H,1-2H3
InChIKeyDIBFVISOFGRRIT-UHFFFAOYSA-N
XLogP2.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.11
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze dimethyl-(2,3,5,6-tetrafluorophenyl)phosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of dimethyl-(2,3,5,6-tetrafluorophenyl)phosphane?
The IUPAC name of dimethyl-(2,3,5,6-tetrafluorophenyl)phosphane (CID 102015616) is dimethyl-(2,3,5,6-tetrafluorophenyl)phosphane.
What is the SMILES notation for dimethyl-(2,3,5,6-tetrafluorophenyl)phosphane?
The canonical SMILES for dimethyl-(2,3,5,6-tetrafluorophenyl)phosphane is CP(C)c1c(F)c(F)cc(F)c1F.
What is the InChIKey of dimethyl-(2,3,5,6-tetrafluorophenyl)phosphane?
The InChIKey is DIBFVISOFGRRIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F4P/c1-13(2)8-6(11)4(9)3-5(10)7(8)12/h3H,1-2H3.
What are the key properties of dimethyl-(2,3,5,6-tetrafluorophenyl)phosphane?
dimethyl-(2,3,5,6-tetrafluorophenyl)phosphane has a molecular weight of 210.11 g/mol, XLogP of 2.61, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(2,3,5,6-tetrafluorophenyl)phosphane is sourced from PubChem (CID 102015616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).