Basic information
- CAS
188985-04-8- Standard SMILES
O=CCN1C(=O)C=CC1=O- InChIKey
WWORFLNFWXZCBF-UHFFFAOYSA-N- Molecular formula
- C6H5NO3
- Average molar mass
- 139.11 g/mol
- Monoisotopic mass
- 139.02694302
Names & identifiers
- Preferred name
- 2-Maleimidoacetaldehyde
- IUPAC
- 2-(2,5-dioxopyrrol-1-yl)acetaldehyde
- English name
- 1H-Pyrrole-1-acetaldehyde, 2,5-dihydro-2,5-dioxo-
- Molecular formula
- C6H5NO3
- Molecular weight
- 139.1088
Names & synonyms
188985-04-82-maleimidoacetaldehyde2-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetaldehyde2-(2,5-dioxopyrrol-1-yl)acetaldehyde1H-Pyrrole-1-acetaldehyde, 2,5-dihydro-2,5-dioxo-maleinimidoacetaldehydSCHEMBL2639486SCHEMBL4595331DTXSID50416056DS-022369(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetaldehydeInChI=1/C6H5NO3/c8-4-3-7-5(9)1-2-6(7)10/h1-2,4H,3H
Database identifiers
- CAS
188985-04-8- PubChem CID
- 5325839
- DTXSID
DTXSID50416056
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 201
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
上海馨远医药科技有限公司021-24206007 13764915196 · [email protected]
杭州宇昊化工科技有限公司0571-82693216 · [email protected]
ZHENGZHOU JIUYI TIME NEW MATERIALS CO,.LTD+8613676922317 · [email protected]
苏州启航生物科技有限公司18662190603 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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