| CAS Number | 1375325-71-5 |
| Catalog Number | AG0013I4(AGN-PC-0WANQS) |
| Chemical Name | Palladium, [2'-(amino-κN)[1,1'-biphenyl]-2-yl-κC]chloro[tris(1,1-dimethylethyl)phosphine]- |
| IUPAC Name | chloropalladium(1+);2-phenylaniline;tritert-butylphosphane |
| InChI | InChI=1S/C12H10N.C12H27P.ClH.Pd/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-10(2,3)13(11(4,5)6)12(7,8)9;;/h1-6,8-9H,13H2;1-9H3;1H;/q-1;;;+2/p-1 |
| InChI Key | DZNFQIYYEXFFGV-UHFFFAOYSA-M |
| MDL Number | MFCD21608496 |
| Molecular Formula | C24H37ClNPPd |
| Molecular Weight | 512.4040 |
| SMILES | P(C(C)(C)C)(C(C)(C)C)(C(C)(C)C)[Pd+2]1([Cl-])[C-]2=CC=CC=C2c2c(N1)cccc2 |
| Synonyms | 1375325-71-5,
Chloro[(tri-tert-butylphosphine)-2-(2-aminobiphenyl)] palladium(II),
P(t-Bu)3 Pd G2,
SY072458,
MFCD21608496 (97%),
Y-200043,
Chloro(tri-tert-butylphosphine)(2 inverted exclamation mark -aminobiphenylyl)palladium(II),
CHLORO[(TRI-TERT-BUTYLPHOSPHINE)-2-(2 1G,
Chloro[(tri-tert-butylphosphine)-2-(2-aminobiphenyl)]palladium(II),
Chloro[(tri-tert-butylphosphine)-2-(2-aminobiphenyl)]palladium(II) =98.0% (by titrimetric analysis),
|
| Complexity | 399 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 511.1387g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 28 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 512.4g/mol |
| Monoisotopic Mass | 511.1387g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 26Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
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Hazard Class
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6.1
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Hazard statements
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H315-H317-H319-H335-H360
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Packing Group
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Ⅲ
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Precautionary statements
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P201-P261-P280-P305+P351+P338-P308+P313
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UN Code
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UN 2811
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Certificate of Analysis
Lot Number