2,9-Dimethylanthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline-1,3,8,10(2H,9H)-tetraone , 92% , 5521-31-3

Synonym(s):
2,9-Dimethyl-anthra[2,1,9-def:6,5,10-d′e′f′]diisoquinoline-1,3,8,10(2H,9H)-tetrone;MePTC;MePTCDI

CAS NO.：5521-31-3

Empirical Formula: C26H14N2O4

Molecular Weight: 418.4

MDL number: MFCD00071975

EINECS: 226-866-1

PRODUCT Properties

• Melting point: >400°C
• Boiling point: 694.8±28.0 °C(Predicted)
• Density: 1.594±0.06 g/cm3(Predicted)
• storage temp.: Store at room temperature
• pka: -2.29±0.20(Predicted)
• form: powder
• color: Orange to Brown to Dark purple
• Water Solubility: 5.5μg/L at 23℃
• semiconductor properties: N-type (mobility=10-5cm2/V·s)
• λmax: 550nm(H2SO4)(lit.)
• InChI: InChI=1S/C26H14N2O4/c1-27-23(29)15-7-3-11-13-5-9-17-22-18(26(32)28(2)25(17)31)10-6-14(20(13)22)12-4-8-16(24(27)30)21(15)19(11)12/h3-10H,1-2H3
• InChIKey: PJQYNUFEEZFYIS-UHFFFAOYSA-N
• SMILES: C1(=O)C2=C3C4C(C5=CC=C6C7=C5C(C=4C=C2)=CC=C7C(=O)N(C)C6=O)=CC=C3C(=O)N1C
• LogP: -0.033 at 23℃
• EPA Substance Registry System: 2,9-Dimethylanthra(2,1,9-def:6,5,10-d'e'f')diisoquinoline-1,3,8,10(2H,9H)-tetrone (5521-31-3)

Description and Uses

Me-PTCDI can be used in the preparation of the hole transporting layers (HTLs), which can further be utilized in the fabrication of perovskite photovoltaic (PPV) cells.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H315-H319-H335
• Precautionary statements: P261-P305+P351+P338
• Hazard Codes: Xi
• Risk Statements: 36/37/38
• Safety Statements: 26
• WGK Germany: 3
• RTECS: CB1590000
• HS Code: 2925.19.4200