Methyltriphenylphosphonium Methylcarbonate - CAS 1067966-63-5
Catalog: |
BB059312 |
Product Name: |
Methyltriphenylphosphonium Methylcarbonate |
CAS: |
1067966-63-5 |
Synonyms: |
Methyltriphenylphosphonium Monomethyl Carbonate; Triphenylmethylphosphonium Monomethylcarbonate |
IUPAC Name: | methyl carbonatemethyl(triphenyl)phosphanium |
Description: | Methyltriphenylphosphonium Methylcarbonate is a wittig vinylation reagent. |
Molecular Weight: | 277.32 + (75.04) |
Molecular Formula: | C19H18P·C2H3O3 |
Canonical SMILES: | COC(=O)[O-].C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3 |
InChI: | InChI=1S/C19H18P.C2H4O3/c1-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-191-5-2(3)4/h2-16H,1H31H3,(H,3,4)/q+1/p-1 |
InChI Key: | FALLFMKOBMQQNQ-UHFFFAOYSA-M |
References: | Cattelan, L., et al. ChemSusChem, 8, 3963 (2015). |
Complexity: | 269 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 352.12283153 |
Formal Charge: | 0 |
Heavy Atom Count: | 25 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 352.12283153 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 49.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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