(6,6)-Phenyl C61 butyric acid methyl ester

Base Information

• Chemical Name: (6,6)-Phenyl C61 butyric acid methyl ester
• CAS No.: 160848-21-5
• Deprecated CAS: 1442463-10-6,1442463-14-0
• Molecular Formula: C72H14O2
• Molecular Weight: 910.88
• Hs Code.: 29156000
• European Community (EC) Number: 801-278-3
• Mol file: 160848-21-5.mol

Synonyms:PCBM;(6,6)-Phenyl C61 butyric acid methyl ester;160848-21-5;PC61BM;MFCD28156570;(6,6)-Phenyl C61 butyricacidmethylester;[6,6]-Phenyl-C61-butyric Acid Methyl Ester;[60]PCBM;Methyl [6,6]-Phenyl-C61-butyrate;Methyl [6.6]-Phenyl-C61-butyrate;FT-0686908;FT-0701450;M2088;P2682;D91578;1-[3-(Methoxycarbonyl)propyl]-1-phenyl-[6.6]C61;[6,6]-Phenyl-C61-butyric Acid Methyl Ester [for organic electronics]

Chemical Property of (6,6)-Phenyl C61 butyric acid methyl ester

Chemical Property:

• Density: 3.019 g/cm³
• XLogP3: 18.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 910.099379685
• Heavy Atom Count: 74
• Complexity: 4190

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: COC(=O)CCCC1(C23C14C5=C6C7=C8C5=C9C1=C5C%10=C%11C%12=C%13C%10=C%10C1=C8C1=C%10C8=C%10C%14=C%15C%16=C%17C(=C%12C%12=C%17C%17=C%18C%16=C%16C%15=C%15C%10=C1C7=C%15C1=C%16C(=C%18C7=C2C2=C%10C(=C5C9=C42)C%11=C%12C%10=C%177)C3=C16)C%14=C%138)C1=CC=CC=C1