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4,4'-(Diphenylsilanediyl)bis(N,N-diphenylaniline)

HCID 23399485
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
205327-13-5
Standard SMILES
c1ccc(N(c2ccccc2)c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1
InChIKey
OOIDMENPSANKCR-UHFFFAOYSA-N
Molecular formula
C48H38N2Si
Average molar mass
670.9 g/mol
Monoisotopic mass
670.28042576

Names & identifiers

Preferred name
4,4'-(Diphenylsilanediyl)bis(N,N-diphenylaniline)
IUPAC
4-[diphenyl-[4-(N-phenylanilino)phenyl]silyl]-N,N-diphenylaniline
English name
4,4'-(Diphenylsilanediyl)bis(N,N-diphenylaniline)
Molecular formula
C48H38N2Si
Molecular weight
670.91

Names & synonyms

4,4'-(Diphenylsilanediyl)bis(N,N-diphenylaniline)RefChem:506480891-390-9205327-13-5TSBPABenzenamine, 4,4'-(diphenylsilylene)bis[N,N-diphenyl-Diphenylbis[4-(diphenylamino)phenyl]silane4-[diphenyl-[4-(N-phenylanilino)phenyl]silyl]-N,N-diphenylanilineSCHEMBL13053135DTXSID00633594CS-0378637N,N'-[(Diphenylsilanediyl)di(4,1-phenylene)]bis(N-phenylaniline)
Show more names
Poly(9,9-bis(6-trimethyl ammoniumiodide)-hexylfluorene-2,7-diyl-alt-(benzo[2,1,3]thiadiazol-4,7-diyl))

Database identifiers

CAS
205327-13-5
PubChem CID
23399485
DTXSID
DTXSID00633594
EC Number
891-390-9
Nikkaji
J2.121.598H

Properties

Computed structural properties

Topological polar surface area
6.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
10
Heavy atoms
51
Formal charge
0
Complexity
861

Physicochemical properties

Boiling point
750.7 · 750.7±60.0 °C(Predicted)
Density
1.22 · 1.22±0.1 g/cm3(Predicted)
pka
-3.1 · -3.10±0.60(Predicted)
form
powder/crystals
color
White
Absorption
309 nm · λmax309 nm in DCM
Fluorescene
376 nm · λem376 nm in DCM
Melting point
213 °C, · mp = 213°C, Tg = 84°C

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Chemistry & industry

Applications · 1 item

Description4,4'-(Diphenylsilanediyl)bis(N,N-diphenylaniline) (TSBPA) isdiphenylsilyl based with two electron donating triphenylamine units. For its electron rich nature, TSBPA is normally used asa high triplet energy hole transport material for blue phosphorescent organic light-emitting diodes (PHOLEDs).

Suppliers10 total

Aladdin Scientific[email protected]
上海尺水药物研究有限公司[email protected] 13564957716 · [email protected]
河南利恩化工产品有限公司0371-63357898 15378766539 · [email protected]
浙江虹舞科技有限公司19705058148 · [email protected]
河南威梯希化工科技有限公司0371-53732842 13383863444 · [email protected]
艾览(上海)化工科技有限公司400-668-9898 · [email protected]
郑州艾克姆化工有限公司13303867194 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
河南科弘生物科技有限公司0371-55969461 18638736641 · [email protected]
泰兴市海川生物科技有限公司19353112242 · [email protected]

Related reactions

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Compound notes

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