Basic information
- CAS
16716-13-5- Standard SMILES
c1ccc(-c2cccc(-c3cccc(-c4cccc(-c5ccccc5)c4)c3)c2)cc1- InChIKey
XQCZQOSQCGDDPQ-UHFFFAOYSA-N- Molecular formula
- C30H22
- Average molar mass
- 382.5 g/mol
- Monoisotopic mass
- 382.1721507
Names & identifiers
- Preferred name
- m-Quinquephenyl
- IUPAC
- 1,3-bis(3-phenylphenyl)benzene
- English name
- m-Quinquephenyl
- Molecular formula
- C30H22
- Molecular weight
- 382.5
Names & synonyms
m-Quinquephenyl16716-13-51,1':3',1'':3'',1''':3''',1''''-Quinquephenylm-Quinquiphenyl26PYG9C635EINECS 240-774-9NSC-90722DTXSID20168237NSC 90722M-TERPHENYL, 3,3''-DIPHENYL-RefChem:154889DTXCID8090728
Show more names
m-Quinquiphenyl in isooctane1,3-Bis(biphenyl-3-yl)benzenem-Quinquephenyl Solution in Hexane1,1':3',1'':3'',1''':3''',1''''-Quinquebenzene
240-774-9XQCZQOSQCGDDPQ-UHFFFAOYSA-N1,3-bis(3-phenylphenyl)benzene3-{[1,1'-BIPHENYL]-3-YL}-3'-PHENYL-1,1'-BIPHENYLMFCD00046058NSC90722NCIOpen2_009823UNII-26PYG9C635
Database identifiers
- CAS
16716-13-5- PubChem CID
- 85566
- DTXSID
DTXSID20168237- UNII
- 26PYG9C635
- EC Number
- 240-774-9
- Nikkaji
- J9.050F
Properties
Computed structural properties
- XLogP
- 8.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 452
Physicochemical properties
- Melting point
- 97 · 97-98 °C(Solv: benzene (71-43-2); ligroine (8032-32-4))
- Boiling point
- 567.7 · 567.7±30.0 °C(Predicted)
- Density
- 1.091 · 1.091±0.06 g/cm3(Predicted)
- FDA UNII
- 26 PYG9C635 · 26PYG9C635
Chemistry & industry
Suppliers1 total
Alchem Pharmtech,Inc.8485655694 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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