Basic information
- CAS
92-21-7- Standard SMILES
COc1cc(OC)c(NC(=O)CC(=O)c2ccc(C(=O)CC(=O)Nc3cc(Cl)c(OC)cc3OC)cc2)cc1Cl- InChIKey
RGJDBFYBXKHCEV-UHFFFAOYSA-N- Molecular formula
- C28H26Cl2N2O8
- Average molar mass
- 589.4 g/mol
- Monoisotopic mass
- 588.1066212
Names & identifiers
- Preferred name
- 1,4-Benzenedipropanamide, N1,N4-bis(5-chloro-2,4-dimethoxyphenyl)-beta1,beta4-dioxo-
- IUPAC
- 3-[4-[3-(5-chloro-2,4-dimethoxyanilino)-3-oxopropanoyl]phenyl]-N-(5-chloro-2,4-dimethoxyphenyl)-3-oxopropanamide
- English name
- A,A'-TEREPHTHALOYLBIS-5-CHLORO-2,4-DIMETHOXYACETANILIDE
- Molecular formula
- C28H26Cl2N2O8
- Molecular weight
- 589.42
Names & synonyms
92-21-7EINECS 202-136-8DTXSID208893341,4-Benzenedipropanamide, N,N'-bis(5-chloro-2,4-dimethoxyphenyl)-beta,beta'-dioxo-1,4-Benzenedipropanamide, N1,N4-bis(5-chloro-2,4-dimethoxyphenyl)-beta1,beta4-dioxo-1,4-Benzenedipropanamide, N1,N4-bis(5-chloro-2,4-dimethoxyphenyl)-.beta.1,.beta.4-dioxo-RefChem:416297DTXCID801982175,5'-Dichloro-2,2',4,4'-tetramethoxy-alpha,alpha'-terephthaloyldiacetanilide3-[4-[3-(5-chloro-2,4-dimethoxyanilino)-3-oxopropanoyl]phenyl]-N-(5-chloro-2,4-dimethoxyphenyl)-3-oxopropanamideN1,N4-Bis(5-chloro-2,4-dimethoxyphenyl)-beta1,beta4-dioxo-1,4-benzenedipropanamide97993-78-7
Show more names
C.I.37615CI NO 37615Naphtol AS-LGNAPHTHOL AS-LGAzoic Coupling Component 35NAPHTHOL AS-LG C.I. NO. 37615C.I.Azoic Coupling Component 35C.I.Azoic Coupling Component 35:C.I.37615A,A'-TEREPHTHALOYLBIS-5-CHLORO-2,4-DIMETHOXYACETANILIDE
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 12
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 814
Physicochemical properties
- Boiling point
- 821.7 · 821.7±65.0 °C(Predicted)
- Density
- 1.379 · 1.379±0.06 g/cm3(Predicted)
- pka
- 8.83 · 8.83±0.25(Predicted)
- EPA Substance Registry System
- 1 · 1,4-Benzenedipropanamide, N,N'-bis(5-chloro-2,4-dimethoxyphenyl)-.beta.,.beta.'-dioxo- (92-21-7)
- 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 Information1,4-Benzenedipropanamide, N1,N4-bis(5-chloro-2,4-dimethoxyphenyl)-.beta.1,.beta.4-dioxo-: INACTIVE
Preparation methods
Preparation5-Chloro-2,4-dimethoxybenzenamine and 1,4-Benzenedicarboxylic acid,bis[2-(ethenylox)ethyl]estercondensation.
Upstream & downstream products
Upstream raw materials
Suppliers1 total
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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