21,22,23,24-Tetraoxapentacyclo(16.2.1.13,6.18,11.113,16)tetracosa-3,5,8,10,13,15,18,20-octaene
Basic information
- CAS
22900-44-3- Standard SMILES
CC1(C)c2ccc(o2)C(C)(C)c2ccc(o2)C(C)(C)c2ccc(o2)C(C)(C)c2ccc1o2- InChIKey
CFODJVUBUNRPAQ-UHFFFAOYSA-N- Molecular formula
- C28H32O4
- Average molar mass
- 432.5 g/mol
- Monoisotopic mass
- 432.2300595
Names & identifiers
- Preferred name
- 21,22,23,24-Tetraoxapentacyclo(16.2.1.13,6.18,11.113,16)tetracosa-3,5,8,10,13,15,18,20-octaene
- IUPAC
- 2,2,7,7,12,12,17,17-octamethyl-21,22,23,24-tetraoxapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1(20),3,5,8,10,13,15,18-octaene
- English name
- CFODJVUBUNRPAQ-UHFFFAOYSA-N
- Molecular formula
- C28H32O4
- Molecular weight
- 432.55
Names & synonyms
22900-44-321,22,23,24-Tetraoxapentacyclo(16.2.1.13,6.18,11.113,16)tetracosa-3,5,8,10,13,15,18,20-octaeneDTXSID401774422,2,7,7,12,12,17,17-Octamethyl-21,22,23,24-tetraoxaquaterene21,22,23,24-Tetraoxapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-3,5,8,10,13,15,18,20-octaeneRefChem:89615DTXCID1099933281-97-0Octamethylcyclotetrafurfurylene2,2,7,7,12,12,17,17-octamethyl-21,22,23,24-tetraoxapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1(20),3,5,8,10,13,15,18-octaeneSCHEMBL24823962CFODJVUBUNRPAQ-UHFFFAOYSA-N
Show more names
21,22,23,24-Tetraoxapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-3,5,8,10,13,15,18,20-octaene, 2,2,7,7,12,12,17,17-octamethyl-
AKOS0243230082,2,7,7,12,12,17,17-octamethyl-21,22,23,24-tetraoxapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1(20),3,5,8,10,13,15,18-octaeneST504431062,2,4,4,6,6,8,8-Octamethyl-1,3,5,7(2,5)-tetrafuranacyclooctaphane21,22,23,24-tetraoxapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-3,5,8,10,13,15,18,20-octaene, 2,2,7,7,12,12,17,17-octamethyl-
Properties
Computed structural properties
- XLogP
- 7.7
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 542
Physicochemical properties
- Melting point
- 241 · 241-242 °C(Solv: benzene (71-43-2))
- Boiling point
- 433.7 · 433.7±40.0 °C(Predicted)
- Density
- 1.037 · 1.037±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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