Methyltriphenylphosphonium chloride

C₁₉H₁₈ClPCAS 1031-15-8312.78 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₉H₁₈ClP
Molar mass: 312.78 g/mol
Exact mass: 312.0835 Da
Melting point: 217–218.5 °C
logP: 0.61Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 3

Hazards

Danger

H302 Harmful if swallowedAcute toxicity, oral
H312 Harmful in contact with skinAcute toxicity, dermal
H315 Causes skin irritationSkin corrosion/irritation
H318 Causes serious eye damageSerious eye damage/eye irritation
H411 Toxic to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI, index 017-016-00-9), via PubChem.

Precautionary statements

P264, P264+P265, P270, P273, P280, P301+P317, P302+P352, P305+P354+P338, P317, P321, P330, P332+P317, P362+P364, P391, P501

Identifiers

CAS number

1031-15-8

SMILES

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

InChIKey

QRPRIOOKPZSVFN-UHFFFAOYSA-M

InChI

InChI=1S/C19H18P.ClH/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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Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names

Phosphonium, methyltriphenyl-, chloride (1:1)
Phosphonium, methyltriphenyl-, chloride
Triphenylmethylphosphonium chloride
B 150
B 150 (Antioxidant)

Work with Methyltriphenylphosphonium chloride

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 iodide2065-66-9Salt

Similar compounds

Tetraphenylphosphonium chloride2001-45-857 % similar Ethyl(triphenyl)phosphonium chloride896-33-350 % similar (Methoxymethyl)triphenylphosphonium chloride4009-98-745 % similar (But-2-ene-1,4-diyl)bis(triphenylphosphanium) dichloride106423-29-444 % similar Benzyltriphenylphosphonium chloride1100-88-544 % similar (p-Phenylenebis(methylene))bis(triphenylphosphonium) dichloride1519-47-744 % similar (Hydroxymethyl)triphenylphosphonium chloride5293-83-444 % similar (Chloromethyl)triphenylphosphonium chloride5293-84-544 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook