62-fluoro-52-(fluoromethyl)tetratetracontacyclo[13.13.13.618,32.521,30.219,20.225,26.14,33.03,29.05,33.06,34.07,35.08,36.09,37.011,37.012,38.013,39.014,40.017,41.028,30.443,44.122,51.023,55.027,49.029,42.031,42.034,43.035,44.036,45.038,45.039,46.040,47.041,48.046,59.047,60.048,57.049,54.051,54.052,61.053,56.053,58.055,58.056,61.057,60.059,62]dohexacontane

C63H38F2 — CID 174297588

About 62-fluoro-52-(fluoromethyl)tetratetracontacyclo[13.13.13.618,32.521,30.219,20.225,26.14,33.03,29.05,33.06,34.07,35.08,36.09,37.011,37.012,38.013,39.014,40.017,41.028,30.443,44.122,51.023,55.027,49.029,42.031,42.034,43.035,44.036,45.038,45.039,46.040,47.041,48.046,59.047,60.048,57.049,54.051,54.052,61.053,56.053,58.055,58.056,61.057,60.059,62]dohexacontane

62-fluoro-52-(fluoromethyl)tetratetracontacyclo[13.13.13.618,32.521,30.219,20.225,26.14,33.03,29.05,33.06,34.07,35.08,36.09,37.011,37.012,38.013,39.014,40.017,41.028,30.443,44.122,51.023,55.027,49.029,42.031,42.034,43.035,44.036,45.038,45.039,46.040,47.041,48.046,59.047,60.048,57.049,54.051,54.052,61.053,56.053,58.055,58.056,61.057,60.059,62]dohexacontane (PubChem CID 174297588) has the molecular formula C63H38F2 and a molecular weight of 832.99 g/mol. Its IUPAC name is 62-fluoro-52-(fluoromethyl)tetratetracontacyclo[13.13.13.618,32.521,30.219,20.225,26.14,33.03,29.05,33.06,34.07,35.08,36.09,37.011,37.012,38.013,39.014,40.017,41.028,30.443,44.122,51.023,55.027,49.029,42.031,42.034,43.035,44.036,45.038,45.039,46.040,47.041,48.046,59.047,60.048,57.049,54.051,54.052,61.053,56.053,58.055,58.056,61.057,60.059,62]dohexacontane.

Molecular Properties

• Compound Name: 62-fluoro-52-(fluoromethyl)tetratetracontacyclo[13.13.13.618,32.521,30.219,20.225,26.14,33.03,29.05,33.06,34.07,35.08,36.09,37.011,37.012,38.013,39.014,40.017,41.028,30.443,44.122,51.023,55.027,49.029,42.031,42.034,43.035,44.036,45.038,45.039,46.040,47.041,48.046,59.047,60.048,57.049,54.051,54.052,61.053,56.053,58.055,58.056,61.057,60.059,62]dohexacontane
• PubChem CID: 174297588
• Molecular Formula: C63H38F2
• Molecular Weight: 832.99 g/mol
• Exact Mass: 832.29
• IUPAC Name: 62-fluoro-52-(fluoromethyl)tetratetracontacyclo[13.13.13.618,32.521,30.219,20.225,26.14,33.03,29.05,33.06,34.07,35.08,36.09,37.011,37.012,38.013,39.014,40.017,41.028,30.443,44.122,51.023,55.027,49.029,42.031,42.034,43.035,44.036,45.038,45.039,46.040,47.041,48.046,59.047,60.048,57.049,54.051,54.052,61.053,56.053,58.055,58.056,61.057,60.059,62]dohexacontane
• SMILES: FCC12C34CC56C7C8C9CC%10C%11C%12C%13C%14C%15C%16CC%17C%18C%19C%20C%21CC%22C%23C%24C%25C%26C%27C%28CC%29C7C53C%29%28C%274C%261C%251C%243C%234C%22%21C%205C%197C%18%19C%16%17C%15%16C%14%15C%13%14C%12%13C(C%12C86C9%10C%11%12%13)C%146C8(F)C21C31C45C72C%16%19C6%15C812
• InChI: InChI=1S/C63H38F2/c64-6-35-34-5-33-23-15-7-1-8-16-24-29-27-21-13-3-11-19-25-20-12-4-14-22-28-30-26-18-10-2-9-17(23)43(33,34)37(9,10)44(18,34)45(26,35)51(30)54(28)50(22)39(12,14)49(20)53(25)48(19)38(11,13)47(21)52(27)46(29)42(24)32(31-40(15,33)36(7,8)41(16,31)42)55(46)59(52)57(47,48)61(53)58(49,50)60(54)56(35,51)63(55,65)62(59,60)61/h7-32H,1-6H2
• InChIKey: DQVVOCIKXNRMBN-UHFFFAOYSA-N
• XLogP: 5.83
• TPSA: 0.00 Ų
• Rotatable Bonds: 1
• Heavy Atoms: 65
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	832.99
LogP ≤ 5	5.83
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Frequently Asked Questions

What is the IUPAC name of 62-fluoro-52-(fluoromethyl)tetratetracontacyclo[13.13.13.618,32.521,30.219,20.225,26.14,33.03,29.05,33.06,34.07,35.08,36.09,37.011,37.012,38.013,39.014,40.017,41.028,30.443,44.122,51.023,55.027,49.029,42.031,42.034,43.035,44.036,45.038,45.039,46.040,47.041,48.046,59.047,60.048,57.049,54.051,54.052,61.053,56.053,58.055,58.056,61.057,60.059,62]dohexacontane?

The IUPAC name of 62-fluoro-52-(fluoromethyl)tetratetracontacyclo[13.13.13.618,32.521,30.219,20.225,26.14,33.03,29.05,33.06,34.07,35.08,36.09,37.011,37.012,38.013,39.014,40.017,41.028,30.443,44.122,51.023,55.027,49.029,42.031,42.034,43.035,44.036,45.038,45.039,46.040,47.041,48.046,59.047,60.048,57.049,54.051,54.052,61.053,56.053,58.055,58.056,61.057,60.059,62]dohexacontane (CID 174297588) is 62-fluoro-52-(fluoromethyl)tetratetracontacyclo[13.13.13.618,32.521,30.219,20.225,26.14,33.03,29.05,33.06,34.07,35.08,36.09,37.011,37.012,38.013,39.014,40.017,41.028,30.443,44.122,51.023,55.027,49.029,42.031,42.034,43.035,44.036,45.038,45.039,46.040,47.041,48.046,59.047,60.048,57.049,54.051,54.052,61.053,56.053,58.055,58.056,61.057,60.059,62]dohexacontane.

What is the SMILES notation for 62-fluoro-52-(fluoromethyl)tetratetracontacyclo[13.13.13.618,32.521,30.219,20.225,26.14,33.03,29.05,33.06,34.07,35.08,36.09,37.011,37.012,38.013,39.014,40.017,41.028,30.443,44.122,51.023,55.027,49.029,42.031,42.034,43.035,44.036,45.038,45.039,46.040,47.041,48.046,59.047,60.048,57.049,54.051,54.052,61.053,56.053,58.055,58.056,61.057,60.059,62]dohexacontane?

The canonical SMILES for 62-fluoro-52-(fluoromethyl)tetratetracontacyclo[13.13.13.618,32.521,30.219,20.225,26.14,33.03,29.05,33.06,34.07,35.08,36.09,37.011,37.012,38.013,39.014,40.017,41.028,30.443,44.122,51.023,55.027,49.029,42.031,42.034,43.035,44.036,45.038,45.039,46.040,47.041,48.046,59.047,60.048,57.049,54.051,54.052,61.053,56.053,58.055,58.056,61.057,60.059,62]dohexacontane is FCC12C34CC56C7C8C9CC%10C%11C%12C%13C%14C%15C%16CC%17C%18C%19C%20C%21CC%22C%23C%24C%25C%26C%27C%28CC%29C7C53C%29%28C%274C%261C%251C%243C%234C%22%21C%205C%197C%18%19C%16%17C%15%16C%14%15C%13%14C%12%13C(C%12C86C9%10C%11%12%13)C%146C8(F)C21C31C45C72C%16%19C6%15C812.

What is the InChIKey of 62-fluoro-52-(fluoromethyl)tetratetracontacyclo[13.13.13.618,32.521,30.219,20.225,26.14,33.03,29.05,33.06,34.07,35.08,36.09,37.011,37.012,38.013,39.014,40.017,41.028,30.443,44.122,51.023,55.027,49.029,42.031,42.034,43.035,44.036,45.038,45.039,46.040,47.041,48.046,59.047,60.048,57.049,54.051,54.052,61.053,56.053,58.055,58.056,61.057,60.059,62]dohexacontane?

The InChIKey is DQVVOCIKXNRMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H38F2/c64-6-35-34-5-33-23-15-7-1-8-16-24-29-27-21-13-3-11-19-25-20-12-4-14-22-28-30-26-18-10-2-9-17(23)43(33,34)37(9,10)44(18,34)45(26,35)51(30)54(28)50(22)39(12,14)49(20)53(25)48(19)38(11,13)47(21)52(27)46(29)42(24)32(31-40(15,33)36(7,8)41(16,31)42)55(46)59(52)57(47,48)61(53)58(49,50)60(54)56(35,51)63(55,65)62(59,60)61/h7-32H,1-6H2.

What are the key properties of 62-fluoro-52-(fluoromethyl)tetratetracontacyclo[13.13.13.618,32.521,30.219,20.225,26.14,33.03,29.05,33.06,34.07,35.08,36.09,37.011,37.012,38.013,39.014,40.017,41.028,30.443,44.122,51.023,55.027,49.029,42.031,42.034,43.035,44.036,45.038,45.039,46.040,47.041,48.046,59.047,60.048,57.049,54.051,54.052,61.053,56.053,58.055,58.056,61.057,60.059,62]dohexacontane?

62-fluoro-52-(fluoromethyl)tetratetracontacyclo[13.13.13.618,32.521,30.219,20.225,26.14,33.03,29.05,33.06,34.07,35.08,36.09,37.011,37.012,38.013,39.014,40.017,41.028,30.443,44.122,51.023,55.027,49.029,42.031,42.034,43.035,44.036,45.038,45.039,46.040,47.041,48.046,59.047,60.048,57.049,54.051,54.052,61.053,56.053,58.055,58.056,61.057,60.059,62]dohexacontane has a molecular weight of 832.99 g/mol, XLogP of 5.83, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 62-fluoro-52-(fluoromethyl)tetratetracontacyclo[13.13.13.618,32.521,30.219,20.225,26.14,33.03,29.05,33.06,34.07,35.08,36.09,37.011,37.012,38.013,39.014,40.017,41.028,30.443,44.122,51.023,55.027,49.029,42.031,42.034,43.035,44.036,45.038,45.039,46.040,47.041,48.046,59.047,60.048,57.049,54.051,54.052,61.053,56.053,58.055,58.056,61.057,60.059,62]dohexacontane is sourced from PubChem (CID 174297588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).