684503

[6, 6]-Pentadeuterophenyl C₆₁ butyric acid methyl ester

99.5%, 99.5 atom % D

• Sinónimos: 1-[3-(Methoxycarbonyl)propyl]-1-pentadeuterophenyl-[6.6] C₆₁, 3′-(Phenyl-d5)3′H-cyclopropyl[1, 9] [5, 6] fullerene-C₆₀-Ih-3′-butanoic acid methyl ester, d5-[60]PCBM
• Fórmula empírica (notación de Hill): C₇₂D₅H₉O₂
• Número de CAS: 749898-80-4
• Peso molecular: 915.91
• Código UNSPSC: 12352103
• NACRES: NA.23

Propiedades

• descripción: functionalized fullerene
• pureza isotópica: 99.5 atom % D
• Análisis: 99.5%
• formulario: powder
• cambio de masa: M+5
• cadena SMILES: [2H]c1c([2H])c([2H])c(c([2H])c1[2H])C2(CCCC(=O)OC)[C]3=4c5c6c7c8c9c%10c(c%11c%12c3c%13c5c%14c%15c6c%16c7c%17c9c%18c%19c%10c%20c%11c%21c%12c%22c%13c%23c%14c%24c%15c%25c%16c%26c%17c%18c%27c%28c%19c%20c%29c%21c%30c%22c%23c%31c%24c%32c%25c%26c%27c%33c%28c%29c%30c%31c%32%33)[C]2=48
• InChI: 1S/C72H14O2/c1-74-11(73)8-5-9-70(10-6-3-2-4-7-10)71-66-58-50-40-30-22-14-12-13-16-20-18(14)26-34-28(20)38-32-24(16)25-17(13)21-19-15(12)23(22)31-37-27(19)35-29(21)39-33(25)43-42(32)52-46(38)56-48(34)54(44(50)36(26)30)62(66)64(56)68-60(52)61-53(43)47(39)57-49(35)55-45(37)51(41(31)40)59(58)67(71)63(55)65(57)69(61)72(68,70)71/h2-4,6-7H,5,8-9H2,1H3/i2D,3D,4D,6D,7D
• Clave InChI: FIGVSQKKPIKBST-QRKCWBMQSA-N

Descripción

Descripción general

[6,6]-Pentadeuterophenyl C₆₁ butyric acid methyl ester (PC₆₀BM) is a deuterated fullerene that can be used as an acceptor molecule. It has a fullerene as the core and deuterium and benzyl as the attachment. The deuterium atoms facilitate an increase in the quantum efficiency of the electrochemical devices.

Aplicación

PC₆₀BM is a conjugating polymer that can be used as an alternative to the conventionally used PCBM for the organic electronic based applications, which include polymeric solar cells and organic light emitting diodes (OLEDs).

Información de seguridad

• Pictogramas: GHS07
• Palabra de señalización: Warning
• Frases de peligro: H315,H319,H335
• Consejos de prudencia: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Clasificaciones de peligro: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• Órganos de actuación: Respiratory system
• Código de clase de almacenamiento: 11 - Combustible Solids
• Clase de riesgo para el agua (WGK): WGK 3
• Punto de inflamabilidad (°F): Not applicable
• Punto de inflamabilidad (°C): Not applicable
• Equipo de protección personal: dust mask type N95 (US), Eyeshields, Gloves