Tris(4-methoxyphenyl)phosphine - CAS 855-38-9
Catalog: |
BB037648 |
Product Name: |
Tris(4-methoxyphenyl)phosphine |
CAS: |
855-38-9 |
Synonyms: |
tris(4-methoxyphenyl)phosphine; tris(4-methoxyphenyl)phosphane |
IUPAC Name: | tris(4-methoxyphenyl)phosphane |
Description: | Tris(4-methoxyphenyl)phosphine (CAS# 855-38-9) is a useful intermediate employed in organic synthesis and in other chemical processes. |
Molecular Weight: | 352.36 |
Molecular Formula: | C21H21O3P |
Canonical SMILES: | COC1=CC=C(C=C1)P(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC |
InChI: | InChI=1S/C21H21O3P/c1-22-16-4-10-19(11-5-16)25(20-12-6-17(23-2)7-13-20)21-14-8-18(24-3)9-15-21/h4-15H,1-3H3 |
InChI Key: | UYUUAUOYLFIRJG-UHFFFAOYSA-N |
Melting Point: | 131-134 °C |
Purity: | 95 % |
Appearance: | White to yellow to orange powder to crystal |
MDL: | MFCD00014896 |
LogP: | 3.47060 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22169871 | 20111204 | Three-component reaction discovery enabled by mass spectrometry of self-assembled monolayers | Nature chemistry |
22199512 | 20111201 | trans-Carbonyl-chloridobis[tris-(4-meth-oxy-phen-yl)phosphane-κP]rhodium(I) | Acta crystallographica. Section E, Structure reports online |
21341814 | 20110318 | Application of Mitsunobu reagents to redox isomerization of CF3-containing propargylic alcohols to (E)-α,β-enones | The Journal of organic chemistry |
21588847 | 20101020 | trans-Dichlorido-bis-[tris(4-meth-oxy-phenyl)-phosphane]palladium(II) toluene solvate | Acta crystallographica. Section E, Structure reports online |
20124678 | 20100201 | Tris(tert-butyl isocyanide)bis[tris(4-methoxyphenyl)phosphine]cobalt(I) perchlorate dichloromethane disolvate and tris(tert-butyl isocyanide)bis[tris(4-methoxyphenyl)phosphine]cobalt(II) bis(perchlorate) dichloromethane disolvate: modification of a trigonal-bipyramidal structure with change of metal oxidation state | Acta crystallographica. Section C, Crystal structure communications |
Complexity: | 310 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
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: | 6 |
Topological Polar Surface Area: | 27.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.5 |
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