(6,6)-Phenyl-C71 Butyric Acid Methyl Ester, mixture of isomers CAS #: 609771-63-3

Synonyms Methyl [6,6]-Phenyl-C71-butyrate, 3′H-Cyclopropa[8,25] [5,6]fullerene-C70-D5h(6)-3′butanoic acid, 3′Phenyl-3′H-cyclopropa[8,25] [5,6]fullerene-C70-D5h(6)-3′butanoic acid, methyl ester, [70]PCBM

Compound Formula: C82H14O2 Molecular Weight: 1030.99 Appearance: Brown to black powder or chunks Melting Point: N/A Boiling Point: N/A Density: N/A Solubility in H2O: N/A Exact Mass: 1030.099 g/mol Monoisotopic Mass: 1030.099 g/mol

Health & Safety Information Signal Word: N/A Hazard Statements: N/A Hazard Codes: N/A Risk Codes: N/A Safety Statements: N/A Transport Information: NONH for all modes of transport WGK Germany: 3

Chemical Identifiers Linear Formula: C82H14O2 Pubchem CID: 71777692 MDL Number: MFCD09842750 EC No.: N/A IUPAC Name: N/A SMILES: COC(=O)CCCC1(C23C14C5=C6C7=C8C9=C1C%10=C%11C9=C9C%12=C%13C%14=C%15C%16=C%17C%18=C%19C%20=C%21C%22=C%23C%24=C%25C%26=C%27C%28=C(C%14=C%14C%12=C%11C%11=C%14C%28=C%26C%12=C%11C%10=C%10C%12=C%25C%23=C%11C%10=C1C7=C%11C%22=C6C4=C%21C%19=C2C%17=C1C%15=C%13C2=C9 InchI Identifier: InChI=1S/C82H14O2/c1-84-11(83)8-5-9-80(10-6-3-2-4-7-10)81-76-68-60-50-40-33-24-18-12-13-15-17-16-14(12)20-27-22(16)31-32-23(17)28-21(15)30-26(19(13)24)35-41(33)51(50)61-55-45(35)37(30)47-39(28)49-43(32)53-52-42(31)48-38(27)46-36-29(20)25(18)34(40)44(36)54 InchI Key: AZSFNTBGCTUQFX-UHFFFAOYSA-N Packing of Standard Packing: Typical bulk packaging includes palletized plastic 5 gallon/25 kg. pails, fiber and steel drums to 1 ton super sacks in full container (FCL) or truck load (T/L) quantities. Research and sample quantities and hygroscopic, oxidizing or other air sensitive materials may be packaged under argon or vacuum. Solutions are packaged in polypropylene, plastic or glass jars up to palletized 444 gallon liquid totes Special package is available on request.