Bis(tri-tert-butylphosphine)palladium(0)

HCID 2734558CAS 53199-31-8

Basic information

Standard SMILES
CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)P(C(C)(C)C)C(C)(C)C.[Pd]
InChIKey
MXQOYLRVSVOCQT-UHFFFAOYSA-N
Molecular formula
C24H54P2Pd
Average molar mass
511.1 g/mol
Monoisotopic mass
510.27356

Names & identifiers

Preferred name
Bis(tri-tert-butylphosphine)palladium(0)
IUPAC
palladium;bis(tritert-butylphosphane)
English name
Bis(tri-tert-butylphosphine)palladium(0)
Molecular formula
C24H56P2Pd
Molecular weight
513.08

Names & synonyms

53199-31-8Bis(tri-tert-butylphosphine)palladium(0)DTXSID80370359RefChem:329913DTXCID10321394640-284-9BIS(TRI-TERT-BUTYLPHOSPHINE)PALLADIUMpalladium;tritert-butylphosphaneBis(tri-t-butylphosphine)palladium(0)bis(tri-tert-butylphosphane) palladiumMFCD03094580PD(T-BU3P)2
Show more names
Pd(P(t-Bu)3)2Bis[tris(tert-butyl)phosphine]palladiumBis[tris(tert-butyl)phosphine]palladium, 20.9% PdBIS(TRI-TERT-BUTYLPHOSPHINE)PALLADIUM (0)bis(tri-tert-butylphosphoranyl)palladiumBis(t
Bis(tri-t-butylphosphine)palladium (0)pd(p(tbu)3)2BIS(TRI-T-BUTYLPHOSPHINE)PALLADIUMC24H54P2PdPalladium, bis[tris(1,1-dimethylethyl)phosphine]-SCHEMBL43560SCHEMBL30986582STR08646

Database identifiers

CAS
53199-31-8
PubChem CID
2734558
DTXSID
DTXSID80370359
EC Number
640-284-9

Properties

Computed structural properties

Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
6
Heavy atoms
27

Physicochemical properties

Melting point
300 °C · >300 °C
storage temp.
-20 °C · -20°C
form
Crystals
color
Off-white to orange-brown
Water Solubility
insoluble
Sensitive
Light, Air & Moisture Sensitive

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H228 (69.7%): Flammable solid [Danger Flammable solids];H251 (66.7%): Self-heating; may catch fire [Danger Self-heating substances and mixtures];H302+H312+H332 (66.7%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation];H302 (75.8%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (75.8%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (97%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (66.7%): May cause an allergic skin reaction [Warning Sensitization, Skin];H319 (97%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (75.8%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (27.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H400 (66.7%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard];H410 (66.7%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P210, P235, P240, P241, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P370+P378, P391, P403+P233, P405, P407, P410, P413, P420, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 33 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesFlam. Sol. 1 (69.7%);Self-heat. 1 (66.7%);Acute Tox. 4 (75.8%);Acute Tox. 4 (75.8%);Skin Irrit. 2 (97%);Skin Sens. 1A (66.7%);Eye Irrit. 2 (97%);Acute Tox. 4 (75.8%);STOT SE 3 (27.3%);Aquatic Acute 1 (66.7%);Aquatic Chronic 1 (66.7%)

Safety data

wgk
3
tsca
No
hs_code
28439000
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07

Chemistry & industry

Applications · 3 items

UsesCatalyst for Suzuki coupling on a multisubstituted sp 3 -carbon (eq. 1) Catalyst for Stille coupling reaction of aryl chlorides 2 (eq. 2) Catalyst for Negishi coupling reaction 3 (eq. 3) Catalyst for Heck coupling to form tetrasubstituted olefins 4 (eq. 4) Catalyst for Buchwald-Hartwig amination of aryl halide 5 (eq. 5) Catalyst for carbonylation of aryl halides with carbamoylsilanes 6 (eq. 6) t -Bu 3 P) 2 catalyst.

UsesBis(tri-tert-butylphosphine)palladium(0) is used in Coupling reactions, Heck couplings. It acts as a palladium catalyst for reductive carbonylation.

General DescriptionThis product has been enhanced for catalytic efficiency.

Suppliers50 total

北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

Related reactions

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Linked notes

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