(2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane

C12H8F6P2 — CID 143472121

IUPAC(2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane
SMILESFc1cc(F)c(F)c(P)c1.Fc1ccc(P)c(F)c1F
InChIInChI=1S/2C6H4F3P/c7-3-1-4(8)6(9)5(10)2-3;7-3-1-2-4(10)6(9)5(3)8/h2*1-2H,10H2
InChIKeySKJOOEVVOCKFRN-UHFFFAOYSA-N
MW328.13 g/mol
LogP3.21
Rot. Bonds

About (2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane

(2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane (PubChem CID 143472121) has the molecular formula C12H8F6P2 and a molecular weight of 328.13 g/mol. Its IUPAC name is (2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane.

Molecular Properties

Compound Name(2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane
PubChem CID143472121
Molecular FormulaC12H8F6P2
Molecular Weight328.13 g/mol
Exact Mass328.00
IUPAC Name(2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane
SMILESFc1cc(F)c(F)c(P)c1.Fc1ccc(P)c(F)c1F
InChIInChI=1S/2C6H4F3P/c7-3-1-4(8)6(9)5(10)2-3;7-3-1-2-4(10)6(9)5(3)8/h2*1-2H,10H2
InChIKeySKJOOEVVOCKFRN-UHFFFAOYSA-N
XLogP3.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.13
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

(3,4-difluoro-2-methylphenyl)phosphane
CID 178005158
1-(2,4-difluorophenyl)-2,3,4-trifluorobenzene
CID 90766512
bis(2,3,4-trifluorophenoxy)-(2,3,5-trifluorophenyl)borane
CID 141042886
1,2,4,5-tetrafluoro-3-(2,3,4-trifluorophenyl)benzene
CID 164665926
1,2,4-trifluoro-3-[2-(2,3,5-trifluorophenyl)phenyl]benzene
CID 161120611
2,3,5-trifluorophenol
CID 2733311
[(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine
CID 105305720
CID 172801487
CID 172801487
2,3,5-trifluorophenol;vanadium
CID 162728237
2,3,4,5-tetrafluoro-N-(2,3,5-trifluorophenyl)aniline
CID 22348698
1-[chloro-(2,4-difluorophenyl)methyl]-2,3,4-trifluorobenzene
CID 79756723
(2,3,4-trifluorophenyl)methylphosphane
CID 21095838

Frequently Asked Questions

What is the IUPAC name of (2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane?
The IUPAC name of (2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane (CID 143472121) is (2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane.
What is the SMILES notation for (2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane?
The canonical SMILES for (2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane is Fc1cc(F)c(F)c(P)c1.Fc1ccc(P)c(F)c1F.
What is the InChIKey of (2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane?
The InChIKey is SKJOOEVVOCKFRN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H4F3P/c7-3-1-4(8)6(9)5(10)2-3;7-3-1-2-4(10)6(9)5(3)8/h2*1-2H,10H2.
What are the key properties of (2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane?
(2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane has a molecular weight of 328.13 g/mol, XLogP of 3.21, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane is sourced from PubChem (CID 143472121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).