N-(2,2-Dimethoxyethyl)phthalimide
Basic information
- CAS
27328-34-3- Standard SMILES
COC(CN1C(=O)c2ccccc2C1=O)OC- InChIKey
HDSDOJMUZFFCFU-UHFFFAOYSA-N- Molecular formula
- C12H13NO4
- Average molar mass
- 235.24 g/mol
- Monoisotopic mass
- 235.0844579
Names & identifiers
- Preferred name
- N-(2,2-Dimethoxyethyl)phthalimide
- IUPAC
- 2-(2,2-dimethoxyethyl)isoindole-1,3-dione
- English name
- N-(2,2-dimethoxyethyl)phthalimide
- Molecular formula
- C12H13NO4
- Molecular weight
- 235.24
Names & synonyms
27328-34-3N-(2,2-Dimethoxyethyl)phthalimide2-(2,2-dimethoxyethyl)-1H-isoindole-1,3(2H)-dioneEINECS 248-412-1DTXSID90181771RefChem:823793DTXCID30104262248-412-12-(2,2-Dimethoxyethyl)isoindoline-1,3-dione2-(2,2-dimethoxyethyl)isoindole-1,3-dione1H-Isoindole-1,3(2H)-dione, 2-(2,2-dimethoxyethyl)-2-(2,2-dimethoxyethyl)-2,3-dihydro-1H-isoindole-1,3-dione
Show more names
PHTHALIMIDOACETALDEHYDE DIMETHYL ACETAL
Oprea1_049936Oprea1_391547CBDivE_014393SCHEMBL1341639434NM3C9V76HMS1682L04AKOS000644347DB-407972
Database identifiers
- CAS
27328-34-3- PubChem CID
- 844086
- DTXSID
DTXSID90181771- UNII
- 34NM3C9V76
- EC Number
- 248-412-1
- Nikkaji
- J250.494D
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 290
Physicochemical properties
- Melting point
- 104 °C · 104 °C
- Boiling point
- 345 · 345.0±32.0 °C(Predicted)
- Density
- 1.262 · 1.262±0.06 g/cm3(Predicted)
- pka
- -2.17 · -2.17±0.20(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
Upstream & downstream products
Upstream raw materials
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…