Tris(2,4-dimethylphenyl)phosphine

C₂₄H₂₇PCAS 49676-42-8346.45 g/mol

Open in Covalent MOL file

Phosphine

Properties

Molecular formula: C₂₄H₂₇P
Molar mass: 346.45 g/mol
Exact mass: 346.1850 Da
logP: 5.30Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 3

Hazards

Warning

H302 Harmful if swallowed97.4% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation97.4% of notifiers

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

49676-42-8

SMILES

CC1=CC(=C(C=C1)P(C2=C(C=C(C=C2)C)C)C3=C(C=C(C=C3)C)C)C

InChIKey

XDHRVAHAGMMFMC-UHFFFAOYSA-N

InChI

InChI=1S/C24H27P/c1-16-7-10-22(19(4)13-16)25(23-11-8-17(2)14-20(23)5)24-12-9-18(3)15-21(24)6/h7-15H,1-6H3

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Work with Tris(2,4-dimethylphenyl)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

1,2,4-Trimethylbenzene95-63-657 % similar 4-Chloro-M-xylene95-66-954 % similar 1-Iodo-2,4-dimethylbenzene4214-28-250 % similar Chloro-p-xylene95-72-750 % similar 2,4-Dimethylphenol105-67-948 % similar 2,4-Dimethylbenzenethiol13616-82-548 % similar N-(2,4-Dimethylphenyl)-2,4-dimethylbenzenamine19616-28-548 % similar Bromo-p-xylene553-94-648 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Tris(3,5-dimethylphenyl)phosphine69227-47-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook