Benzoylmethyltriphenylphosphonium chloride - CAS 1678-18-8
Catalog: |
BB043436 |
Product Name: |
Benzoylmethyltriphenylphosphonium chloride |
CAS: |
1678-18-8 |
Synonyms: |
Phosphonium, (2-oxo-2-phenylethyl)triphenyl-, chloride (1:1); Phenacyltriphenylphosphonium chloride; Phosphonium, (2-oxo-2-phenylethyl)triphenyl-, monochloride; Phosphonium, phenacyltriphenyl-, chloride; (Benzoylmethyl)triphenylphosphonium chloride; NSC 601820 |
Related CAS: | 17638-55-0 (free base)
|
IUPAC Name: | phenacyl(triphenyl)phosphanium;chloride |
Molecular Weight: | 416.88 |
Molecular Formula: | C26H22ClOP |
Canonical SMILES: | C1=CC=C(C=C1)C(=O)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-] |
InChI: | InChI=1S/C26H22OP.ClH/c27-26(22-13-5-1-6-14-22)21-28(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25;/h1-20H,21H2;1H/q+1;/p-1 |
InChI Key: | OWTCGJRBQMOICX-UHFFFAOYSA-M |
Melting Point: | 267-271°C |
Purity: | ≥95% |
Complexity: | 431 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 416.10968 |
Formal Charge: | 0 |
Heavy Atom Count: | 29 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 416.10968 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 17.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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