Basic information
- CAS
67499-50-7- Standard SMILES
CC(=O)Nc1cccc(OCCOc2cccc(NC(C)=O)c2)c1- InChIKey
JWNGEAIYEQJHSS-UHFFFAOYSA-N- Molecular formula
- C18H20N2O4
- Average molar mass
- 328.4 g/mol
- Monoisotopic mass
- 328.14230712
Names & identifiers
- Preferred name
- 3',3''-(Ethylenedioxy)diacetanilide
- IUPAC
- N-[3-[2-(3-acetamidophenoxy)ethoxy]phenyl]acetamide
- English name
- 3',3''-(Ethylenedioxy)diacetanilide
- Molecular formula
- C18H20N2O4
- Molecular weight
- 328.36
Names & synonyms
67499-50-73',3''-(ethylenedioxy)diacetanilideRefChem:484493653-198-1N-(3-{2-[3-(acetylamino)phenoxy]ethoxy}phenyl)acetamideN,N'-((Ethane-1,2-diylbis(oxy))bis(3,1-phenylene))diacetamideMaybridge1_002052N-[3-[2-(3-acetamidophenoxy)ethoxy]phenyl]acetamideSCHEMBL11546092HMS547F06CCG-55742AKOS024334062
Show more names
3',3'-(ETHYLENEDIOXY)DIACETANILIDEAcetamide, N,N'-[1,2-ethanediylbis(oxy-3,1-phenylene)]bis- (9CI)
SR-01000644751-1
Database identifiers
- CAS
67499-50-7- PubChem CID
- 2802155
- EC Number
- 653-198-1
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 378
Physicochemical properties
- Boiling point
- 629.3 · 629.3±50.0 °C(Predicted)
- Density
- 1.241 · 1.241±0.06 g/cm3(Predicted)
- pka
- 14.35 · 14.35±0.70(Predicted)
- Symbol(GHS)
- 9 · GHS09
- Signal word
- Warning
- Hazard statements
- 400 · H400
- Precautionary statements
- 273 · P273-P391-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS09
- Hazard statements
- H400
- Precautionary statements
- P273-P391-P501
Chemistry & industry
Suppliers1 total
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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