Methyltriphenylphosphonium iodide

C₁₉H₁₈IPCAS 2065-66-9404.23 g/mol

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Properties

Molecular formula: C₁₉H₁₈IP
Molar mass: 404.23 g/mol
Exact mass: 404.0191 Da
Melting point: 182–183 °C
logP: 0.61Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 3

Hazards

Danger

H301 Toxic if swallowed10.4% of notifiers
H315 Causes skin irritation97.9% of notifiers
H319 Causes serious eye irritation97.9% of notifiers
H335 May cause respiratory irritation95.8% of notifiers

Aggregated from 48 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

2065-66-9

SMILES

C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[I-]

InChIKey

JNMIXMFEVJHFNY-UHFFFAOYSA-M

InChI

InChI=1S/C19H18P.HI/c1-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19;/h2-16H,1H3;1H/q+1;/p-1

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Names and synonyms

4 names

Phosphonium, methyltriphenyl-, iodide (1:1)
Phosphonium, methyltriphenyl-, iodide
Triphenylmethylphosphinium iodide
Triphenylmethylphosphonium iodide

Work with Methyltriphenylphosphonium iodide

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Methyltriphenylphosphonium bromide1779-49-3Salt Methyltriphenylphosphonium chloride1031-15-8Salt

Similar compounds

Tetraphenylphosphonium iodide2065-67-057 % similar Isopropyltriphenylphosphonium iodide24470-78-850 % similar Ethyltriphenylphosphonium iodide4736-60-150 % similar (N-Methyl-N-phenylamino)triphenylphosphonium iodide34257-63-145 % similar (Trimethylsilylmethyl)triphenylphosphonium iodide3739-98-845 % similar Methyltriphenylarsonium iodide1499-33-838 % similar Trimethylphenylammonium iodide98-04-438 % similar Tetraphenylphosphonium chloride2001-45-838 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Iodomethyltriphenylphosphorane20667-19-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook