Methyltriphenylphosphonium iodide

• CAS: 2065-66-9
• Catalog Number: ACM2065669-1
• Category: Organic Phosphine Compounds
• Molecular Weight: 404.22
• Molecular Formula: C19H18PI
• Synonyms: Triphenylmethylphosphine iodide
• IUPAC Name: methyl(triphenyl)phosphanium;iodide
• Canonical SMILES: C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]
• InChI: JNMIXMFEVJHFNY-UHFFFAOYSA-M
• InChI Key: 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
• Melting Point: 183-185 °C(lit.)
• Appearance: Solid
• Application: suzuki reaction
• Storage: Store under inert gas
• Active Content: 95%
• Complexity: 235
• Condition To Avoid: Light Sensitive,Hygroscopic
• Covalently-Bonded Unit Count: 2
• EC Number: 218-178-5
• Exact Mass: 404.019g/mol
• Hazard Statements: H315 : Causes skin irritation.H319 : Causes serious eye irritation.
• H-Bond Acceptor: 1
• Heavy Atom Count: 21
• Isomeric SMILES: C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]
• MDL Number: MFCD00066175
• Monoisotopic Mass: 404.019g/mol
• NSC Number: 132585
• Physical State: Solid
• Precautionary Statements: P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
• Rotatable Bond Count: 3
• Signal Word: Warning
• Topological Polar Surface Area: 0A^2
• UNII: 3B2B7G7R4G

Custom Q&A

What is the CAS number for Methyltriphenylphosphonium iodide?

CAS numbers for Methyltriphenylphosphonium iodide are 2065-66-9, 1560-52-7, and 20667-19-0.

How many heavy atoms are present in the computed properties of Methyltriphenylphosphonium iodide?

There are 21 heavy atoms present in the computed properties of Methyltriphenylphosphonium iodide.

What is the molecular formula of Methyltriphenylphosphonium iodide?

The molecular formula of Methyltriphenylphosphonium iodide is C19H18IP.

What is the Canonical SMILES representation of Methyltriphenylphosphonium iodide?

The Canonical SMILES representation of Methyltriphenylphosphonium iodide is C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[I-].

What is the InChIKey of Methyltriphenylphosphonium iodide?

The InChIKey of Methyltriphenylphosphonium iodide is JNMIXMFEVJHFNY-UHFFFAOYSA-M.

How many rotatable bonds are present in Methyltriphenylphosphonium iodide?

There are 3 rotatable bonds present in Methyltriphenylphosphonium iodide.

What is the exact mass of Methyltriphenylphosphonium iodide?

The exact mass of Methyltriphenylphosphonium iodide is 404.01909.

What is the Monoisotopic Mass of Methyltriphenylphosphonium iodide?

The Monoisotopic Mass of Methyltriphenylphosphonium iodide is 404.01909.

What is the IUPAC Name of Methyltriphenylphosphonium iodide?

The IUPAC Name of Methyltriphenylphosphonium iodide is methyl(triphenyl)phosphanium;iodide.

How many different synonyms are provided for Methyltriphenylphosphonium iodide?

There are several synonyms provided for Methyltriphenylphosphonium iodide, including methyl triphenylphosphonium iodide, Triphenylmethylphosphinium iodide, and Methyltriphenylphosphanium iodide.

Synthetic Use

Downstream Synthesis Route 1

• 2052-15-5
• 2065-66-9

• 999-24-6

Reference: [1]Journal of Organometallic Chemistry,1965,vol. 3,p. 101 - 106

Downstream Synthesis Route 2

• 14252-05-2
• 2065-66-9

• 4877-39-8

Reference: [1]Journal of the Chemical Society. Perkin transactions II,1975,p. 1726 - 1733

Downstream Synthesis Route 3

• 10259-22-0
• 2065-66-9

• 25108-57-0

Reference: [1]Journal of Organic Chemistry,1979,vol. 44,p. 3157 - 3168

* For details of the synthesis route, please refer to the original source to ensure accuracy.