2-[3-Bromo-5-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-1,3,5-tri(propan-2-yl)benzene
Basic information
- CAS
443295-47-4- Standard SMILES
CC(C)c1cc(C(C)C)c(-c2cc(Br)cc(-c3c(C(C)C)cc(C(C)C)cc3C(C)C)c2)c(C(C)C)c1- InChIKey
DOJFXAXSXSJQGN-UHFFFAOYSA-N- Molecular formula
- C36H49Br
- Average molar mass
- 561.7 g/mol
- Monoisotopic mass
- 560.30176
Names & identifiers
- Preferred name
- 2-[3-Bromo-5-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-1,3,5-tri(propan-2-yl)benzene
- IUPAC
- 2-[3-bromo-5-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-1,3,5-tri(propan-2-yl)benzene
Names & synonyms
443295-47-4DTXSID805142962~5~-Bromo-1~2~,1~4~,1~6~,3~2~,3~4~,3~6~-hexa(propan-2-yl)-1~1~,2~1~:2~3~,3~1~-terphenyl
Database identifiers
- CAS
443295-47-4- PubChem CID
- 12979593
- DTXSID
DTXSID80514296- Nikkaji
- J2.288.662B
Properties
Computed structural properties
- XLogP
- 12.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 8
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 582
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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