Basic information
- CAS
2432878-13-0- Standard SMILES
Nc1ccc(C2=CC(c3ccc(N)cc3)=C3C=Cc4c(-c5ccc(N)cc5)cc(-c5ccc(N)cc5)c5c4C3C2=CC5)cc1- InChIKey
GKNNZVARYXIKNG-UHFFFAOYSA-N- Molecular formula
- C40H32N4
- Average molar mass
- 568.7 g/mol
- Monoisotopic mass
- 568.26269704
Names & identifiers
- Preferred name
- 4,4',4'',4'''-(3a1,5-Dihydropyrene-1,3,6,8-tetrayl)tetraaniline
- IUPAC
- 4-[3,6,8-tris(4-aminophenyl)-10,10c-dihydropyren-1-yl]aniline
- English name
- PYR12
- Molecular formula
- C40H32N4
- Molecular weight
- 568.71
Names & synonyms
4,4',4'',4'''-(3a1,5-Dihydropyrene-1,3,6,8-tetrayl)tetraaniline2432878-13-04-[3,6,8-tris(4-aminophenyl)-10,10c-dihydropyren-1-yl]anilinePYR12MFCD345985681, 3, 6, 8-Tetra (4-aminophenyl) pyreneF756004,?4',?4'',?4'''-?(5,?10b-?dihydro-?1,?3,?6,?8-?pyrenetetrayl)?tetrakis-Benzenamine4,4',4'',4'''-(5,10b-dihydro-1,3,6,8-pyrenetetrayl)tetrakis-BenzenamineBenzenamine, 4,4',4'',4'''-(10,10c-dihydro-1,3,6,8-pyrenetetrayl)tetrakis-
Database identifiers
- CAS
2432878-13-0- PubChem CID
- 147656676
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 1,160
Physicochemical properties
- Boiling point
- 900 · 900.0±65.0 °C(Predicted)
- Density
- 1.36 · 1.36±0.1 g/cm3(Predicted)
- pka
- 5.08 · 5.08±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Chemistry & industry
Suppliers11 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
深圳睿迅光电材料科技有限公司0755-26718755; 15889762949 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
深圳睿迅光电材料科技有限公司0755-26718755 13266723223 · [email protected]
河南威梯希化工科技有限公司0371-53732842 13383863444 · [email protected]
湖南嘉航医药科技有限公司85567275 18932438858 · [email protected]
河南拉瓦锡化工产品有限公司0371-63682289 18625781376 · [email protected]
沃尔吉明（北京）技术开发院18610294897 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
扬州摩笛尔电子材料有限公司13761402923 19975033992 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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