Tris(4-fluorophenyl)phosphine

C₁₈H₁₂F₃PCAS 18437-78-0316.26 g/mol

Open in Covalent MOL file

Aryl halide Phosphine

Properties

Molecular formula: C₁₈H₁₂F₃P
Molar mass: 316.26 g/mol
Exact mass: 316.0629 Da
logP: 3.86Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 3

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation97.8% of notifiers

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

18437-78-0

SMILES

C1=CC(=CC=C1F)P(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

InChIKey

GEPJPYNDFSOARB-UHFFFAOYSA-N

InChI

InChI=1S/C18H12F3P/c19-13-1-7-16(8-2-13)22(17-9-3-14(20)4-10-17)18-11-5-15(21)6-12-18/h1-12H

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with Tris(4-fluorophenyl)phosphine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,4-Difluorobenzene540-36-360 % similar 4,4′-Difluorobiphenyl398-23-250 % similar 1,4-Bis(diphenylphosphino)benzene1179-06-247 % similar Fluorobenzene462-06-644 % similar Tris(4-trifluoromethylphenyl)phosphine13406-29-643 % similar 4,4′-Difluorobenzhydryl chloride27064-94-443 % similar Bis(4-fluorophenyl)methanol365-24-243 % similar 1-(Dichloromethyl)-4-fluorobenzene456-19-943 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Tris(3-fluorophenyl)phosphine23039-94-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook