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Substance Name: Buckminsterfullerene
RN: 99685-96-8
UNII: NP9U26B839
InChIKey: XMWRBQBLMFGWIX-UHFFFAOYSA-N

Note

  • A polyhedral CARBON structure composed of around 60-80 carbon atoms in pentagon and hexagon configuration. They are named after Buckminster Fuller because of structural resemblance to geodesic domes. Fullerenes can be made in high temperature such as arc discharge in an inert atmosphere.

Molecular Formula

  • C60

Molecular Weight

  • 720.66
 
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Names and Synonyms

Name of Substance

  • Buckminsterfullerene
  • Fullerene C60

Synonyms

  • Buckminsterfullerene
  • C60 Compound
  • C60 Fullerene
  • CCRIS 9349
  • Fullerene
  • Fullerene 60
  • Fullerene C60
  • UNII-NP9U26B839

Systematic Names

  • (5,6)Fullerene-C60-Ih
  • Footballene

Registry Numbers

CAS Registry Number

  • 99685-96-8

FDA UNII

  • NP9U26B839

System Generated Number

  • 0099685968

Structure Descriptors

InChI

1S/C60/c1-2-5-6-3(1)8-12-10-4(1)9-11-7(2)17-21-13(5)23-24-14(6)22-18(8)28-20(12)30-26-16(10)15(9)25-29-19(11)27(17)37-41-31(21)33(23)43-44-34(24)32(22)42-38(28)48-40(30)46-36(26)35(25)45-39(29)47(37)55-49(41)51(43)57-52(44)50(42)56(48)59-54(46)53(45)58(55)60(57)59

InChIKey

XMWRBQBLMFGWIX-UHFFFAOYSA-N

Smiles

c12c3c4c5c6c7c8c9c%10c%11c%12c%13c(c5c7%11)c3c3c5c2c2c7c%11c%14c%15c%16c%17c(c6c%16c4c1c7%15)c8c1c9c4c6c7c8c9c(c5c2c2c%11c5c(c92)c7c4c2c5c%14c%17c12)c(c8c%12c%106)c%133