684449

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

≥99%

• Synonym(s): 1-[3-(Methoxycarbonyl)propyl]-1-phenyl-[6.6]C₆₁, 3′H-Cyclopropa[1,9] [5,6]fullerene-C₆₀-Ih-3′-butanoic acid 3′-phenyl methyl ester, PCBM, [60]PCBM
• Empirical Formula (Hill Notation): C₇₂H₁₄O₂
• CAS Number: 160848-22-6
• Molecular Weight: 910.88
• MDL number: MFCD07784544
• UNSPSC Code: 12352103
• PubChem Substance ID: 24885805
• NACRES: NA.23

Properties

• description: functionalized fullerene
• Quality Level: 100
• Assay: ≥99%
• form: solid
• Orbital energy: HOMO 6.1 eV ; LUMO 3.7 eV
• semiconductor properties: N-type (mobility=0.21 cm²/V·s)
• SMILES string: COC(=O)CCCC2(c1ccccc1)[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)71-66-59-52-40-32-23-14-12-13-15-18(14)27-34(32)42-43-35(27)33-24(15)26-22-17(13)20-19-16(12)21-25(23)38(40)46-44-30(21)28(19)36-37-29(20)31(22)45-47-39(26)41(33)53-55(43)64(63(66)54(42)52)67-60(53)58(47)62-51(45)49(37)56-48(36)50(44)61(57(46)59)68(71)65(56)69(62)72(67,70)71/h2-4,6-7H,5,8-9H2,1H3
• InChI key: MCEWYIDBDVPMES-UHFFFAOYSA-N

Description

General description

(6,6)-Phenyl C₆₁ butyric acid methyl ester ((60) PCBM) is a methanofullerene that has a better diffusion in organic molecules than fullerenes (C₆₀). It has a high electron mobility which allows it to be used as an electron acceptor in major electrochemical applications.

[6,6]-Phenyl C₆₁ butyric acid methyl ester ([60]PCBM) is a methanofullerene that has a better diffusion in organic molecules than fullerenes (C₆₀). It has high electron mobility, which allows it to be used as an electron acceptor in major electrochemical applications.

Application

(60)PCBM is an n-type semi-conductor widely used as an a electron transport material with low cost and high surface area in different energy based applications like organic photovoltaics, perovskite solar cells, field effect transistors and photodetectors.

[60]PCBM is an n-type semi-conductor with low cost and high surface area. It is widely used as an electron transport material in various energy-based applications like organic photovoltaics, perovskite solar cells, field effect transistors, and photodetectors.

Soluble n-channel organic semiconductor. For use as an n-type layer in plastic electronics, especially bulk heterojunction OFETs and photovoltaic cells (PVs).

Safety Information

• Storage Class Code: 11 - Combustible Solids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves