[2,7-Di(tert-butyl)-9,9-dimethylxanthene-4,5-diyl]bis(diphenylphosphine) - CAS 221462-97-1
Catalog: |
BB017421 |
Product Name: |
[2,7-Di(tert-butyl)-9,9-dimethylxanthene-4,5-diyl]bis(diphenylphosphine) |
CAS: |
221462-97-1 |
Synonyms: |
(2,7-ditert-butyl-5-diphenylphosphino-9,9-dimethyl-4-xanthenyl)-diphenylphosphine; (2,7-ditert-butyl-5-diphenylphosphanyl-9,9-dimethylxanthen-4-yl)-diphenylphosphane |
IUPAC Name: | [2,7-ditert-butyl-9,9-dimethyl-5-[methyl(phenyl)phosphanyl]xanthen-4-yl]-methyl-phenylphosphane |
Description: | [2,7-Di(tert-butyl)-9,9-dimethylxanthene-4,5-diyl]bis(diphenylphosphine) (CAS# 221462-97-1 ) is a useful research chemical. |
Molecular Weight: | 690.83 |
Molecular Formula: | C47H48OP2 |
Canonical SMILES: | CC1(C2=CC(=CC(=C2OC3=C(C=C(C=C31)C(C)(C)C)P(C4=CC=CC=C4)C5=CC=CC=C5)P(C6=CC=CC=C6)C7=CC=CC=C7)C(C)(C)C)C |
InChI: | InChI=1S/C47H48OP2/c1-45(2,3)33-29-39-43(41(31-33)49(35-21-13-9-14-22-35)36-23-15-10-16-24-36)48-44-40(47(39,7)8)30-34(46(4,5)6)32-42(44)50(37-25-17-11-18-26-37)38-27-19-12-20-28-38/h9-32H,1-8H3 |
InChI Key: | KDKJDGIJQNFICS-UHFFFAOYSA-N |
LogP: | 8.83820 |
Complexity: | 760 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 566.28674002 |
Formal Charge: | 0 |
Heavy Atom Count: | 40 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 566.28674002 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 9.2 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 9.9 |
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