Propanediamide, 2-[2-[5-(benzoylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl]diazenyl]-N1,N3-bis(2,3-dichlorophenyl)-
Basic information
- CAS
67837-03-0- Standard SMILES
O=C(Nc1cccc2c1C(=O)c1cccc(N=NC(C(=O)Nc3cccc(Cl)c3Cl)C(=O)Nc3cccc(Cl)c3Cl)c1C2=O)c1ccccc1- InChIKey
UYUMJRLBPXJPGE-UHFFFAOYSA-N- Molecular formula
- C36H21Cl4N5O5
- Average molar mass
- 745.4 g/mol
- Monoisotopic mass
- 743.02968
Names & identifiers
- Preferred name
- Propanediamide, 2-[2-[5-(benzoylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl]diazenyl]-N1,N3-bis(2,3-dichlorophenyl)-
- IUPAC
- 2-[(5-benzamido-9,10-dioxoanthracen-1-yl)diazenyl]-N,N'-bis(2,3-dichlorophenyl)propanediamide
- English name
- 2-[[5-(benzoylamino)-9,10-dihydro-9,10-dioxoanthryl]azo]-N,N'-bis(2,3-dichlorophenyl)propanediamide
- Molecular formula
- C36H21Cl4N5O5
- Molecular weight
- 745.39
Names & synonyms
EINECS 267-301-9Propanediamide, 2-[[5-(benzoylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl]azo]-N,N'-bis(2,3-dichlorophenyl)-Propanediamide, 2-((5-(benzoylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl)azo)-N,N'-bis(2,3-dichlorophenyl)-Propanediamide, 2-(2-(5-(benzoylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl)diazenyl)-N1,N3-bis(2,3-dichlorophenyl)-Propanediamide, 2-[2-[5-(benzoylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl]diazenyl]-N1,N3-bis(2,3-dichlorophenyl)-RefChem:86887867837-03-02-[[5-(benzoylamino)-9,10-dihydro-9,10-dioxoanthryl]azo]-N,N'-bis(2,3-dichlorophenyl)propanediamide2-((5-(Benzoylamino)-9,10-dihydro-9,10-dioxoanthryl)azo)-N,N'-bis(2,3-dichlorophenyl)propanediamideWA6KG94XSEDTXSID7070684UYUMJRLBPXJPGE-UHFFFAOYSA-N
Show more names
N,N'-Bis(2,3-dichlorophenyl)-2-[(5-benzoylamino-1-anthraquinonyl)azo]malonamide
NS000362162-[(5-Benzamido-9,10-dioxo-9,10-dihydroanthracen-1-yl)diazenyl]-N~1~,N~3~-bis(2,3-dichlorophenyl)propanediamide2-[2-[5-(Benzoylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl]diazenyl]-N1,N3-bis(2,3-dichlorophenyl)propanediamide
Properties
Computed structural properties
- XLogP
- 10.1
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 50
- Formal charge
- 0
- Complexity
- 1,280
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Boiling point
- 888 · 888.0±65.0 °C(Predicted)
- Density
- 1.53 · 1.53±0.1 g/cm3(Predicted)
- pka
- -4.02 · -4.02±0.59(Predicted)
- EPA Substance Registry System
- 2 · Propanediamide, 2-[[5-(benzoylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl]azo]-N,N'-bis(2,3-dichlorophenyl)- (67837-03-0)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPropanediamide, 2-[2-[5-(benzoylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl]diazenyl]-N1,N3-bis(2,3-dichlorophenyl)-: INACTIVE
Related reactions
0 records
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Compound notes
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