[6,6]-Pentadeuterophenyl‑C₆₁‑butyric Acid Methyl Ester (d₅‑PCBM)

[6,6]-Pentadeuterophenyl‑C₆₁‑butyric Acid Methyl Ester (d₅‑PCBM)

Deuterated Reagents – Electronics

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Description

Deuterium‑labelled fullerene derivative used in organic photovoltaics (OPV), organic electronics, and charge‑transport studies.

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Technical Specifications
CAS Number (labelled) 749898-80-4
CAS Number (unlabelled) 160848‑22‑6
Product No. D-088
Categories Deuterated Reagents – Electronics
Quantity
Size Availability
100 mg On Demand
250 mg On Demand
Purity ≥ 99%
Isotopic Enrichment ≥ 99% D
Storage Conditions Store at room temperature in a tightly sealed container, protected from light.
Synonym(s) 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-PCBM
Formula C₇₂D₅H₉O₂
SMILES COC(CCCC2(C%33=C([2H])C([2H])=C([2H])C([2H])=C%33[2H])C1%19C5=C%14C4=C3C12C%20=C%17C%16=C3C%15=C4C%12=C%10C(C%15=C%26C%16=C%31C%17=C%29C%21=C(C%28=C%29C%30=C%31%32)C%22=C%18C%19=C%20%21)=C%27C9=C%25C8=C%24C%23=C7C6=C(C%22=C%23C%28=C%24C%30=C%25C%32=C%26%27)C%18=C5C%13=C6C%11=C7C8=C9C%10=C%11C%12=C%13%14)=O
Shipping Hazards Non‑hazardous chemical
Functional Groups Fullerene cage; Phenyl group; Butyric acid methyl ester
Stability Stable under recommended conditions
Molecular Weight 915.9 g/mol
DOT/IATA Transport Information Not regulated as a dangerous good
Min. Purity Spec ≥ 99%
For COA or MSDS, please provide the product and lot number.

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