N,N'-Dibenzylidene-3,3'-dichlorobenzidine
Basic information
- CAS
10147-75-8- Standard SMILES
Clc1cc(-c2ccc(N=Cc3ccccc3)c(Cl)c2)ccc1N=Cc1ccccc1- InChIKey
PXPMURPRMMGGBR-UHFFFAOYSA-N- Molecular formula
- C26H18Cl2N2
- Average molar mass
- 429.3 g/mol
- Monoisotopic mass
- 428.084704
Names & identifiers
- Preferred name
- N,N'-Dibenzylidene-3,3'-dichlorobenzidine
- IUPAC
- N-[4-[4-(benzylideneamino)-3-chlorophenyl]-2-chlorophenyl]-1-phenylmethanimine
- English name
- N,N'-Bisbenzylidene-3,3'-dichlorobenzidine
- Molecular formula
- C26H18Cl2N2
- Molecular weight
- 429.34
Names & synonyms
10147-75-8N-[4-[4-(benzylideneamino)-3-chlorophenyl]-2-chlorophenyl]-1-phenylmethanimineN,N/'-BISBENZYLIDENE-3,3/'-DICHLOROBENZIDINEN,N'-Dibenzylidene-3,3'-dichlorobenzidineN,N'-BISBENZYLIDENE-3,3'-DICHLOROBENZIDINESCHEMBL11418273SCHEMBL12416697DTXSID10348309PXPMURPRMMGGBR-YAGSLNJISA-N(E,E)-N,N'-(3,3'-Dichloro[1,1'-biphenyl]-4,4'-diyl)bis(1-phenylmethanimine)BisbenzylidenedichlorobenzidineN,N'-Dibenzylidene-3,3'-dichloro-1,1'-biphenyl-4,4'-diamine
Show more names
[1,1'-Biphenyl]-4,4'-diamine, 3,3'-dichloro-N4,N4'-bis(phenylmethylene)-
Database identifiers
- CAS
10147-75-8- PubChem CID
- 634720
- DTXSID
DTXSID10348309- Nikkaji
- J150.279D
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 24.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 515
Physicochemical properties
- Melting point
- 159 °C · 159 °C
- Boiling point
- 630.6 · 630.6±55.0 °C(Predicted)
- Density
- 1.17 · 1.17±0.1 g/cm3(Predicted)
- pka
- 2.48 · 2.48±0.50(Predicted)
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Compound notes
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