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5068-21-3 | (4-Hydroxyphenyl)diphenylphosphine
CAS No: 5068-21-3 Catalog No: AG003BW2 MDL No:
Product Description
Catalog Number:
AG003BW2
Chemical Name:
(4-Hydroxyphenyl)diphenylphosphine
CAS Number:
5068-21-3
Molecular Formula:
C18H15OP
Molecular Weight:
278.2849
IUPAC Name:
4-diphenylphosphanylphenol
InChI:
InChI=1S/C18H15OP/c19-15-11-13-18(14-12-15)20(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-14,19H
InChI Key:
QOPABJOZVXZFJG-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)P(c1ccccc1)c1ccccc1
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.086g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.291g/mol
Monoisotopic Mass:
278.086g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
Literature
| Title | Journal |
|---|---|
| 4-(Diphenyl-phosphino-yl)benzoic acid. | Acta crystallographica. Section E, Structure reports online 20081101 |
| Three-centre hydrogen bonds in triphenyl-phosphine oxide-hydro-quinone (1/1). | Acta crystallographica. Section E, Structure reports online 20080201 |
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