Basic information
- CAS
92996-46-8- Standard SMILES
Nc1ccc(-c2sc(-c3ccc(N)cc3)c(-c3ccccc3)c2-c2ccccc2)cc1- InChIKey
RQXOOKSFELPROF-UHFFFAOYSA-N- Molecular formula
- C28H22N2S
- Average molar mass
- 418.6 g/mol
- Monoisotopic mass
- 418.15036988
Names & identifiers
- Preferred name
- 2,5-Bis(4-aminophenyl)-3,4-diphenylthiophene
- IUPAC
- 4-[5-(4-aminophenyl)-3,4-diphenylthiophen-2-yl]aniline
- English name
- 4-[5-(4-aminophenyl)-3,4-diphenyl-2-thienyl]phenylamine
- Molecular formula
- C28H22N2S
- Molecular weight
- 418.55268
Names & synonyms
92996-46-82,5-Bis(4-aminophenyl)-3,4-diphenylthiopheneBenzenamine, 4,4'-(3,4-diphenyl-2,5-thiophenediyl)bis-4-[5-(4-aminophenyl)-3,4-diphenylthiophen-2-yl]anilineCBDivE_002813SCHEMBL8582553DTXSID80348295RQXOOKSFELPROF-UHFFFAOYSA-NSTK258689AKOS0036456084,4'-(3,4-diphenylthiene-2,5-diyl)dianiline4,4'-(3,4-Diphenylthiophene-2,5-diyl)dianiline
Show more names
AH-034/113663974-[5-(4-Aminophenyl)-3,4-diphenyl-2-thienyl]phenylamine4-[5-(4-Aminophenyl)-3,4-diphenyl-2-thienyl]phenylamine #
Database identifiers
- CAS
92996-46-8- PubChem CID
- 634491
- DTXSID
DTXSID80348295- Nikkaji
- J670.675D
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 80.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 491
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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