N-(2-Hydroxyethyl)maleimide
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Basic information
- CAS
1585-90-6- Standard SMILES
O=C1C=CC(=O)N1CCO- InChIKey
AXTADRUCVAUCRS-UHFFFAOYSA-N- Molecular formula
- C6H7NO3
- Average molar mass
- 141.12 g/mol
- Monoisotopic mass
- 141.04259308
Names & identifiers
- Preferred name
- N-(2-Hydroxyethyl)maleimide
- IUPAC
- 1-(2-hydroxyethyl)pyrrole-2,5-dione
- English name
- 1-(2-HYDROXY-ETHYL)-PYRROLE-2,5-DIONE
- Molecular formula
- C6H7NO3
- Molecular weight
- 141.12
Names & synonyms
N-(2-hydroxyethyl)maleimideRefChem:825492696-457-41585-90-61-(2-Hydroxyethyl)-1H-pyrrole-2,5-dione1-(2-Hydroxy-ethyl)-pyrrole-2,5-dione1-(2-hydroxyethyl)pyrrole-2,5-dioneMFCD004652661-(2-hydroxyethyl)-2,5-dihydro-1H-pyrrole-2,5-dione1H-Pyrrole-2,5-dione, 1-(2-hydroxyethyl)-N-2-Hydroxy-ethymaleimideDTXSID70332522
Show more names
N-(Ethanol)maleimideN-Hydroxyethyl MaleiMideN-hydroxyethylMaleiciMide1-(2-Hydroxyethyl)maleimideN-(2-Hydroxyethyl)MaleiMide,99%N-(2-Hydroxyethyl)MaleiMide 97%
FD6042AB90352EN300-1219752-Maleimidylethanol2-maleimidyl ethanolHEMIFT-0657724N-(2hydroxyethyl)maleimide
Database identifiers
- CAS
1585-90-6- PubChem CID
- 458487
- DTXSID
DTXSID70332522- EC Number
- 696-457-4
- Nikkaji
- J1.049.861I
Properties
Computed structural propertiesFilling in
- XLogP
- -0.1
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 179
Physicochemical properties
- Melting point
- 66 · 66-67 °C (lit.) 67-74 °C
- Boiling point
- 130 °C/0.005mmHg · 130°C/0.005mmHg(lit.)
- Density
- 1.395 · 1.395
- storage temp.
- 2 · 2-8°C
- form
- Powder
- pka
- 14.21 · 14.21±0.10(Predicted)
- color
- white
- InChI
- InChI=1S/C6H7NO3/c8-4-3-7-5(9)1-2-6(7)10/h1-2,8H,3-4H2
- InChIKey
- AXTADRUCVAUCRS-UHFFFAOYSA-N
- SMILES
- N1(CCO)C(=O)C=CC1=O
- CAS DataBase Reference
- 1585 · 1585-90-6
- UNSPSC Code
- 12352111 · 12352111
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
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
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 42 reports by companies from 4 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2A (100%)
Safety data
- wgk
- 3
- hs_code
- 2925.19.9100
- risk_code
- 22-36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 26
- Hazard statements
- H319
- Precautionary statements
- P305+P351+P338
Chemistry & industry
Applications
Description1-(2-hydroxymethyl)-1-H-pyrrole-2,5-dione is a synthetic building block for adding an maleimide group with a hydroxyl handle. The hydroxyl group enables further derivatization or replacement with other reactive functional groups.
Uses1-(2-Hydroxy-ethyl)-pyrrole-2,5-dione is a substituted succinimide with antibacterial and cytotoxic activities.
Upstream & downstream products
Upstream raw materials
Related reactions
13 records
Compound notes
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