[6,6]-Phenyl C 61 methyl butyrate - ≥99.5% , CAS No.160848-22-6

CAS: 160848-22-6 Cat. No.: P400139 Molecular Weight: 910.88

GRADE & PURITY ≥99.5%

Synonyms

[60]PCBM | Methyl [6,6]-Phenyl-C61-butyrate | D91578 | FT-0686908 | [6,6]-Phenyl-C61-butyric Acid Methyl Ester [for organic electronics] | (6,6)-Phenyl C61 butyric acid methyl ester | PC61BM | (6,6)-Phenyl C61 butyricacidmethylester;[6,6]-Phenyl-C61-butyr

Storage

Protected from light,Argon charged,Room temperature

Specifications

Synonyms

[60]PCBM | Methyl [6, 6]-Phenyl-C61-butyrate | D91578 | FT-0686908 | [6, 6]-Phenyl-C61-butyric Acid Methyl Ester [for organic electronics] | (6, 6)-Phenyl C61 butyric acid methyl ester | PC61BM | (6, 6)-Phenyl C61 butyricacidmethylester;[6, 6]-Phenyl-C61-butyr

Specifications & Purity

≥99.5%

Storage

Protected from light, Argon charged, Room temperature

Purity

≥99.5%

Names and Identifiers

• Pubchem Sid: 488201591
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488201591
• Isomeric 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
• WGK Germany: 3
• Molecular Weight: 910.88
• Reaxy-Rn: 15873127
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=15873127&ln=

Chemical and Physical Properties

• Sensitivity: light sensitive
• Molecular Weight: 910.900 g/mol
• XLogP3: 18.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 910.099 Da
• Monoisotopic Mass: 910.099 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 74
• Formal Charge: 0
• Complexity: 4190.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 2
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

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