| CAS Number | 181259-35-8 |
| Catalog Number | AG0022RN(AGN-PC-0QBYR3) |
| Chemical Name | Phosphonium, tetraphenyl-, tetrakis(4-methylphenyl)borate(1-) (1:1) |
| IUPAC Name | tetrakis(4-methylphenyl)boranuide;tetraphenylphosphanium |
| InChI | InChI=1S/C28H28B.C24H20P/c1-21-5-13-25(14-6-21)29(26-15-7-22(2)8-16-26,27-17-9-23(3)10-18-27)28-19-11-24(4)12-20-28;1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h5-20H,1-4H3;1-20H/q-1;+1 |
| InChI Key | FAYPBNFHFCEUQZ-UHFFFAOYSA-N |
| MDL Number | MFCD08274957 |
| Molecular Formula | C51H46BP |
| Molecular Weight | 700.6957 |
| SMILES | CC1=CC=C([B-](C2=CC=C(C)C=C2)(C3=CC=CC=C3)C4=CC=C(C)C=C4)C=C1.C5([P+](C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8)=CC=CC=C5 |
| Synonyms | Tetraphenylphosphonium Tetra-p-tolylborate,
181259-35-8,
SCHEMBL503790,
CTK8B2944,
DTXSID40630289,
ANW-41420,
MFCD08274957,
AKOS015911603,
RTR-008329,
TR-008329,
J-011578,
I14-38116,
Tetraphenylphosphanium tetrakis(4-methylphenyl)borate(1-),
FAYPBNFHFCEUQZ-UHFFFAOYSA-N,
T2603,
|
| Complexity | 688 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 714.359g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 54 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 714.74g/mol |
| Monoisotopic Mass | 714.359g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number