Dichloro-(4,5-bis(diphenylphosphino)-9,9-dimethylxanthene)palladium(II)

HCID 60153068CAS 205319-10-4

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Basic information

Standard SMILES: CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.[Cl][Pd][Cl]
InChIKey: HEYONDYPXIUDCK-UHFFFAOYSA-L
Molecular formula: C39H32Cl2OP2Pd
Average molar mass: 755.9 g/mol

Names & identifiers

Preferred name: Dichloro-(4,5-bis(diphenylphosphino)-9,9-dimethylxanthene)palladium(II)
IUPAC: dichloropalladium;(5-diphenylphosphanyl-9,9-dimethylxanthen-4-yl)-diphenylphosphane
English name: Dichloro[9,9-dimethyl-4,5-bis(diphenylphosphino)xanthene]palladium(II), min. 98%
Molecular formula: C39H34Cl2OP2Pd
Molecular weight: 757.97

Names & synonyms

205319-10-4RefChem:586712Dichloro-(4,5-bis(diphenylphosphino)-9,9-dimethylxanthene)palladium(II)685-312-0DICHLORO[9,9-DIMETHYL-4,5-BIS(DIPHENYLPHOSPHINO)XANTHENE]PALLADIUM(II)dichloropalladium;(5-diphenylphosphanyl-9,9-dimethylxanthen-4-yl)-diphenylphosphane[4,5-Bis(diphenylphosphino)-9,9-dimethylxanthene]dichloropalladium(II)PdCl2(Xant-Phos)Dichloro[9,9-dimethyl-4,5- bis(diphenylphosphino)xanthene]palladium(II)FP973NGT7QSCHEMBL12466735SCHEMBL29721416

Show more names

Pd(XantPhos)Cl2Dichloro[9,9-diMethyl-4,5-bis(diphenylphosphino)xantheneDichloro[9PdCl2.XantPhosoro[9,9-dimethyL-4,5-bis(diphenyLphosphino)xanthene]paLDichloro[9,9-diMethyl-4,5-bis(bis(diphenylphosphino)xanthene]palladiuM(II)

SCHEMBL31581392AKOS024462646FD60980F10280[4,5-Bis(diphenylphosphino)-9,9-dimethylxanthene]palladium(II ) DichlorideDichloro[9,9-dimethyl-4,5-bis(diphenylphosphino)xanthene]palladium(II), 95%(SP-4-2)-Dichloro[1,1'-(9,9-dimethyl-9H-xanthene-4,5-diyl)bis[1,1-diphenylphosphine-kappaP]]palladium

Database identifiers

CAS: 205319-10-4
PubChem CID: 60153068
UNII: FP973NGT7Q
EC Number: 685-312-0

Properties

Computed structural properties

Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 6
Heavy atoms: 45
Formal charge: 0
Complexity: 734

Physicochemical properties

Melting point: 280 · 280-287℃
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
form: Crystalline solid
color: Yellow
InChIKey: HEYONDYPXIUDCK-UHFFFAOYSA-L
SMILES: [Cl-][Pd+2]1(P(C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=C3C(C)(C)C4=CC=CC(=C4OC=23)P1(C1C=CC=CC=1)C1C=CC=CC=1)[Cl-]
CAS DataBase Reference: 205319 · 205319-10-4
UNSPSC Code: 12161600 · 12161600
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 317 · H317
Precautionary statements: 261 · P261-P280g-P302+P352a-P321-P333+P313-P501a
Risk Statements: 43 · 43
Safety Statements: 24 · 24-37-60
WGK Germany: 3 · 3
TSCA: No
HS Code: 2932.99 · 2932.99.7000
Storage Class: 11 · 11 - Combustible Solids

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H228 (84.6%): Flammable solid [Danger Flammable solids]

P210, P240, P241, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 26 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.